Organoheterocyclic compounds
Filtered Search Results
2-(1-Piperazinylcarbonyl)-1,4-benzodioxane Hydrochloride 98.0+%, TCI America™
CAS: 70918-74-0 Molecular Formula: C13H17ClN2O3 Molecular Weight (g/mol): 284.74 MDL Number: MFCD00729051 InChI Key: TUKBWYXLYINULI-UHFFFAOYSA-N Synonym: 1-[(1,4-Benzodioxan-2-yl)carbonyl]piperazine Hydrochloride PubChem CID: 2822434 IUPAC Name: 2,3-dihydro-1,4-benzodioxin-3-yl(piperazin-1-yl)methanone;hydrochloride SMILES: C1CN(CCN1)C(=O)C2COC3=CC=CC=C3O2.Cl
| PubChem CID | 2822434 |
|---|---|
| CAS | 70918-74-0 |
| Molecular Weight (g/mol) | 284.74 |
| MDL Number | MFCD00729051 |
| SMILES | C1CN(CCN1)C(=O)C2COC3=CC=CC=C3O2.Cl |
| Synonym | 1-[(1,4-Benzodioxan-2-yl)carbonyl]piperazine Hydrochloride |
| IUPAC Name | 2,3-dihydro-1,4-benzodioxin-3-yl(piperazin-1-yl)methanone;hydrochloride |
| InChI Key | TUKBWYXLYINULI-UHFFFAOYSA-N |
| Molecular Formula | C13H17ClN2O3 |
3-Phenylpyrazole 98.0+%, TCI America™
CAS: 2458-26-6 Molecular Formula: C9H8N2 Molecular Weight (g/mol): 144.18 MDL Number: MFCD00159654 InChI Key: OEDUIFSDODUDRK-UHFFFAOYSA-N Synonym: 3-phenyl-1h-pyrazole,3-phenylpyrazole,1h-pyrazole, 3-phenyl,pyrazole, 3-phenyl,3-benzylpyrazole,3-phenylpyrazol,phenylpyrazole,3-phenyl-2h-pyrazole,chembl38876,5-phenylpyrazole PubChem CID: 17155 IUPAC Name: 5-phenyl-1H-pyrazole SMILES: N1N=CC=C1C1=CC=CC=C1
| PubChem CID | 17155 |
|---|---|
| CAS | 2458-26-6 |
| Molecular Weight (g/mol) | 144.18 |
| MDL Number | MFCD00159654 |
| SMILES | N1N=CC=C1C1=CC=CC=C1 |
| Synonym | 3-phenyl-1h-pyrazole,3-phenylpyrazole,1h-pyrazole, 3-phenyl,pyrazole, 3-phenyl,3-benzylpyrazole,3-phenylpyrazol,phenylpyrazole,3-phenyl-2h-pyrazole,chembl38876,5-phenylpyrazole |
| IUPAC Name | 5-phenyl-1H-pyrazole |
| InChI Key | OEDUIFSDODUDRK-UHFFFAOYSA-N |
| Molecular Formula | C9H8N2 |
2,4-Piperidinedione 98.0+%, TCI America™
CAS: 50607-30-2 Molecular Formula: C5H7NO2 Molecular Weight (g/mol): 113.116 MDL Number: MFCD08704814 InChI Key: RDNZDMDLRIQQAX-UHFFFAOYSA-N Synonym: 2,4-piperidinedione,2,4-piperadinedione,2,4-dioxopiperidine,2,4-diketopiperidine,piperidin-2,4-dione,2,4 dioxopiperdine,2, 4-dioxopiperidine,pubchem22543,acmc-209ko8 PubChem CID: 10887863 IUPAC Name: piperidine-2,4-dione SMILES: C1CNC(=O)CC1=O
| PubChem CID | 10887863 |
|---|---|
| CAS | 50607-30-2 |
| Molecular Weight (g/mol) | 113.116 |
| MDL Number | MFCD08704814 |
| SMILES | C1CNC(=O)CC1=O |
| Synonym | 2,4-piperidinedione,2,4-piperadinedione,2,4-dioxopiperidine,2,4-diketopiperidine,piperidin-2,4-dione,2,4 dioxopiperdine,2, 4-dioxopiperidine,pubchem22543,acmc-209ko8 |
| IUPAC Name | piperidine-2,4-dione |
| InChI Key | RDNZDMDLRIQQAX-UHFFFAOYSA-N |
| Molecular Formula | C5H7NO2 |
Prulifloxacin 98.0+%, TCI America™
CAS: 123447-62-1 Molecular Formula: C21H20FN3O6S Molecular Weight (g/mol): 461.46 MDL Number: MFCD00864847 InChI Key: PWNMXPDKBYZCOO-UHFFFAOYNA-N PubChem CID: 65947 IUPAC Name: 6-fluoro-1-methyl-7-{4-[(5-methyl-2-oxo-2H-1,3-dioxol-4-yl)methyl]piperazin-1-yl}-4-oxo-1H,4H-[1,3]thiazeto[3,2-a]quinoline-3-carboxylic acid SMILES: CC1SC2=C(C(O)=O)C(=O)C3=CC(F)=C(C=C3N12)N1CCN(CC2=C(C)OC(=O)O2)CC1
| PubChem CID | 65947 |
|---|---|
| CAS | 123447-62-1 |
| Molecular Weight (g/mol) | 461.46 |
| MDL Number | MFCD00864847 |
| SMILES | CC1SC2=C(C(O)=O)C(=O)C3=CC(F)=C(C=C3N12)N1CCN(CC2=C(C)OC(=O)O2)CC1 |
| IUPAC Name | 6-fluoro-1-methyl-7-{4-[(5-methyl-2-oxo-2H-1,3-dioxol-4-yl)methyl]piperazin-1-yl}-4-oxo-1H,4H-[1,3]thiazeto[3,2-a]quinoline-3-carboxylic acid |
| InChI Key | PWNMXPDKBYZCOO-UHFFFAOYNA-N |
| Molecular Formula | C21H20FN3O6S |
Paclobutrazol 98.0+%, TCI America™
CAS: 76738-62-0 Molecular Formula: C15H20ClN3O Molecular Weight (g/mol): 293.795 MDL Number: MFCD01678673 InChI Key: RMOGWMIKYWRTKW-LSLKUGRBSA-N Synonym: paclobutrazol,2s-1-4-chlorophenyl-4,4-dimethyl-2-1,2,4-triazol-1-yl-3-pentanol,2s-1-4-chlorophenyl-4,4-dimethyl-2-1,2,4-triazol-1-yl pentan-3-ol PubChem CID: 53297383 IUPAC Name: (2S)-1-(4-chlorophenyl)-4,4-dimethyl-2-(1,2,4-triazol-1-yl)pentan-3-ol SMILES: CC(C)(C)C(C(CC1=CC=C(C=C1)Cl)N2C=NC=N2)O
| PubChem CID | 53297383 |
|---|---|
| CAS | 76738-62-0 |
| Molecular Weight (g/mol) | 293.795 |
| MDL Number | MFCD01678673 |
| SMILES | CC(C)(C)C(C(CC1=CC=C(C=C1)Cl)N2C=NC=N2)O |
| Synonym | paclobutrazol,2s-1-4-chlorophenyl-4,4-dimethyl-2-1,2,4-triazol-1-yl-3-pentanol,2s-1-4-chlorophenyl-4,4-dimethyl-2-1,2,4-triazol-1-yl pentan-3-ol |
| IUPAC Name | (2S)-1-(4-chlorophenyl)-4,4-dimethyl-2-(1,2,4-triazol-1-yl)pentan-3-ol |
| InChI Key | RMOGWMIKYWRTKW-LSLKUGRBSA-N |
| Molecular Formula | C15H20ClN3O |
1,3-Dithiane 97.0+%, TCI America™
CAS: 505-23-7 Molecular Formula: C4H8S2 Molecular Weight (g/mol): 120.228 MDL Number: MFCD00006654 InChI Key: WQADWIOXOXRPLN-UHFFFAOYSA-N Synonym: 1,3-dithiacyclohexane,m-dithiane,dithiane-1,3,1,3-dithian,dithiane-1,3 french,1,3 dithiane,ccris 6777,m-dithiane, 8ci,1,3 dithiocyclohexane,acmc-209knk PubChem CID: 10451 ChEBI: CHEBI:47845 IUPAC Name: 1,3-dithiane SMILES: C1CSCSC1
| PubChem CID | 10451 |
|---|---|
| CAS | 505-23-7 |
| Molecular Weight (g/mol) | 120.228 |
| ChEBI | CHEBI:47845 |
| MDL Number | MFCD00006654 |
| SMILES | C1CSCSC1 |
| Synonym | 1,3-dithiacyclohexane,m-dithiane,dithiane-1,3,1,3-dithian,dithiane-1,3 french,1,3 dithiane,ccris 6777,m-dithiane, 8ci,1,3 dithiocyclohexane,acmc-209knk |
| IUPAC Name | 1,3-dithiane |
| InChI Key | WQADWIOXOXRPLN-UHFFFAOYSA-N |
| Molecular Formula | C4H8S2 |
3-Phenylisoxazole-5-carboxylic Acid 98.0+%, TCI America™
CAS: 14442-12-7 Molecular Formula: C10H7NO3 Molecular Weight (g/mol): 189.17 MDL Number: MFCD01936010 InChI Key: YGTFDJRCCBKLDM-UHFFFAOYSA-N Synonym: 3-phenylisoxazole-5-carboxylic acid,3-phenyl-5-isoxazolecarboxylic acid,5-isoxazolecarboxylic acid, 3-phenyl,3-phenyl-isoxazole-5-carboxylic acid,phenylisoxazolecarboxylicacid,5-carboxy-3-phenylisoxazole,3-phenylisoxazole-5-carboxylic,3-phenyl-5-isoxazolecarboxylicacid,3-phenylisoxazole-5-carboxylicacid,3-phenyl-5-isoxazole carboxylic acid PubChem CID: 737474 IUPAC Name: 3-phenyl-1,2-oxazole-5-carboxylic acid SMILES: C1=CC=C(C=C1)C2=NOC(=C2)C(=O)O
| PubChem CID | 737474 |
|---|---|
| CAS | 14442-12-7 |
| Molecular Weight (g/mol) | 189.17 |
| MDL Number | MFCD01936010 |
| SMILES | C1=CC=C(C=C1)C2=NOC(=C2)C(=O)O |
| Synonym | 3-phenylisoxazole-5-carboxylic acid,3-phenyl-5-isoxazolecarboxylic acid,5-isoxazolecarboxylic acid, 3-phenyl,3-phenyl-isoxazole-5-carboxylic acid,phenylisoxazolecarboxylicacid,5-carboxy-3-phenylisoxazole,3-phenylisoxazole-5-carboxylic,3-phenyl-5-isoxazolecarboxylicacid,3-phenylisoxazole-5-carboxylicacid,3-phenyl-5-isoxazole carboxylic acid |
| IUPAC Name | 3-phenyl-1,2-oxazole-5-carboxylic acid |
| InChI Key | YGTFDJRCCBKLDM-UHFFFAOYSA-N |
| Molecular Formula | C10H7NO3 |
9-Phenyl-3-(4,4,5,5-tetramethyl-1,3,2-dioxaborolan-2-yl)carbazole 98.0+%, TCI America™
CAS: 1126522-69-7 Molecular Formula: C24H24BNO2 Molecular Weight (g/mol): 369.27 MDL Number: MFCD16621140 InChI Key: UBASCOPZFCGGAV-UHFFFAOYSA-N Synonym: 9-Phenylcarbazole-3-boronic Acid Pinacol Ester, 4,4,5,5-Tetramethyl-2-(9-phenylcarbazol-3-yl)-1,3,2-dioxaborolane PubChem CID: 57415695 IUPAC Name: 9-phenyl-3-(4,4,5,5-tetramethyl-1,3,2-dioxaborolan-2-yl)-9H-carbazole SMILES: CC1(C)OB(OC1(C)C)C1=CC2=C(C=C1)N(C1=C2C=CC=C1)C1=CC=CC=C1
| PubChem CID | 57415695 |
|---|---|
| CAS | 1126522-69-7 |
| Molecular Weight (g/mol) | 369.27 |
| MDL Number | MFCD16621140 |
| SMILES | CC1(C)OB(OC1(C)C)C1=CC2=C(C=C1)N(C1=C2C=CC=C1)C1=CC=CC=C1 |
| Synonym | 9-Phenylcarbazole-3-boronic Acid Pinacol Ester, 4,4,5,5-Tetramethyl-2-(9-phenylcarbazol-3-yl)-1,3,2-dioxaborolane |
| IUPAC Name | 9-phenyl-3-(4,4,5,5-tetramethyl-1,3,2-dioxaborolan-2-yl)-9H-carbazole |
| InChI Key | UBASCOPZFCGGAV-UHFFFAOYSA-N |
| Molecular Formula | C24H24BNO2 |
9-Phenyl-3,6-bis[4-(1-phenylbenzimidazol-2-yl)phenyl]carbazole 98.0+%, TCI America™
CAS: 1258780-50-5 Molecular Formula: C56H37N5 Molecular Weight (g/mol): 779.947 InChI Key: CWUOZRFIMAVZLO-UHFFFAOYSA-N PubChem CID: 101525816 IUPAC Name: 9-phenyl-3,6-bis[4-(1-phenylbenzimidazol-2-yl)phenyl]carbazole SMILES: C1=CC=C(C=C1)N2C3=C(C=C(C=C3)C4=CC=C(C=C4)C5=NC6=CC=CC=C6N5C7=CC=CC=C7)C8=C2C=CC(=C8)C9=CC=C(C=C9)C1=NC2=CC=CC=C2N1C1=CC=CC=C1
| PubChem CID | 101525816 |
|---|---|
| CAS | 1258780-50-5 |
| Molecular Weight (g/mol) | 779.947 |
| SMILES | C1=CC=C(C=C1)N2C3=C(C=C(C=C3)C4=CC=C(C=C4)C5=NC6=CC=CC=C6N5C7=CC=CC=C7)C8=C2C=CC(=C8)C9=CC=C(C=C9)C1=NC2=CC=CC=C2N1C1=CC=CC=C1 |
| IUPAC Name | 9-phenyl-3,6-bis[4-(1-phenylbenzimidazol-2-yl)phenyl]carbazole |
| InChI Key | CWUOZRFIMAVZLO-UHFFFAOYSA-N |
| Molecular Formula | C56H37N5 |
6-Phenyl-3(2H)-pyridazinone 98.0+%, TCI America™
CAS: 2166-31-6 Molecular Formula: C10H8N2O Molecular Weight (g/mol): 172.187 MDL Number: MFCD00114953 InChI Key: IJUIPRDMWWBTTQ-UHFFFAOYSA-N Synonym: 3-Hydroxy-6-phenylpyridazine PubChem CID: 75106 IUPAC Name: 3-phenyl-1H-pyridazin-6-one SMILES: C1=CC=C(C=C1)C2=NNC(=O)C=C2
| PubChem CID | 75106 |
|---|---|
| CAS | 2166-31-6 |
| Molecular Weight (g/mol) | 172.187 |
| MDL Number | MFCD00114953 |
| SMILES | C1=CC=C(C=C1)C2=NNC(=O)C=C2 |
| Synonym | 3-Hydroxy-6-phenylpyridazine |
| IUPAC Name | 3-phenyl-1H-pyridazin-6-one |
| InChI Key | IJUIPRDMWWBTTQ-UHFFFAOYSA-N |
| Molecular Formula | C10H8N2O |
Polyethylene Glycol Glycidyl Lauryl Ether, TCI America™
CAS: 86630-59-3 Molecular Formula: C17H34O3 Molecular Weight (g/mol): 286.456 InChI Key: ZCCBLVOOWREKMV-UHFFFAOYSA-N PubChem CID: 22986560 IUPAC Name: 2-(2-dodecoxyethoxymethyl)oxirane SMILES: CCCCCCCCCCCCOCCOCC1CO1
| PubChem CID | 22986560 |
|---|---|
| CAS | 86630-59-3 |
| Molecular Weight (g/mol) | 286.456 |
| SMILES | CCCCCCCCCCCCOCCOCC1CO1 |
| IUPAC Name | 2-(2-dodecoxyethoxymethyl)oxirane |
| InChI Key | ZCCBLVOOWREKMV-UHFFFAOYSA-N |
| Molecular Formula | C17H34O3 |
Paliperidone 97.0+%, TCI America™
CAS: 144598-75-4 Molecular Formula: C23H27FN4O3 Molecular Weight (g/mol): 426.492 InChI Key: PMXMIIMHBWHSKN-UHFFFAOYSA-N Synonym: paliperidone,9-hydroxyrisperidone,invega,9-oh-risperidone,invega sustenna,xeplion,palliperidone,3-2-4-6-fluoro-1,2-benzisoxazol-3-yl-1-piperidinyl ethyl-6,7,8,9-tetrahydro-9-hydroxy-2-methyl-4h-pyrido 1,2-a pyrimidin-4-one,chembl1621,3-2-4-6-fluorobenzo d isoxazol-3-yl piperidin-1-yl ethyl-9-hydroxy-2-methyl-6,7,8,9-tetrahydro-4h-pyrido 1,2-a pyrimidin-4-one PubChem CID: 115237 ChEBI: CHEBI:83804 IUPAC Name: 3-[2-[4-(6-fluoro-1,2-benzoxazol-3-yl)piperidin-1-yl]ethyl]-9-hydroxy-2-methyl-6,7,8,9-tetrahydropyrido[1,2-a]pyrimidin-4-one SMILES: CC1=C(C(=O)N2CCCC(C2=N1)O)CCN3CCC(CC3)C4=NOC5=C4C=CC(=C5)F
| PubChem CID | 115237 |
|---|---|
| CAS | 144598-75-4 |
| Molecular Weight (g/mol) | 426.492 |
| ChEBI | CHEBI:83804 |
| SMILES | CC1=C(C(=O)N2CCCC(C2=N1)O)CCN3CCC(CC3)C4=NOC5=C4C=CC(=C5)F |
| Synonym | paliperidone,9-hydroxyrisperidone,invega,9-oh-risperidone,invega sustenna,xeplion,palliperidone,3-2-4-6-fluoro-1,2-benzisoxazol-3-yl-1-piperidinyl ethyl-6,7,8,9-tetrahydro-9-hydroxy-2-methyl-4h-pyrido 1,2-a pyrimidin-4-one,chembl1621,3-2-4-6-fluorobenzo d isoxazol-3-yl piperidin-1-yl ethyl-9-hydroxy-2-methyl-6,7,8,9-tetrahydro-4h-pyrido 1,2-a pyrimidin-4-one |
| IUPAC Name | 3-[2-[4-(6-fluoro-1,2-benzoxazol-3-yl)piperidin-1-yl]ethyl]-9-hydroxy-2-methyl-6,7,8,9-tetrahydropyrido[1,2-a]pyrimidin-4-one |
| InChI Key | PMXMIIMHBWHSKN-UHFFFAOYSA-N |
| Molecular Formula | C23H27FN4O3 |
3-(1-Piperazinyl)-1,2-benzisothiazole 98.0+%, TCI America™
CAS: 87691-87-0 Molecular Formula: C11H13N3S Molecular Weight (g/mol): 219.306 MDL Number: MFCD04117970 InChI Key: KRDOFMHJLWKXIU-UHFFFAOYSA-N PubChem CID: 2772144 IUPAC Name: 3-piperazin-1-yl-1,2-benzothiazole SMILES: C1CN(CCN1)C2=NSC3=CC=CC=C32
| PubChem CID | 2772144 |
|---|---|
| CAS | 87691-87-0 |
| Molecular Weight (g/mol) | 219.306 |
| MDL Number | MFCD04117970 |
| SMILES | C1CN(CCN1)C2=NSC3=CC=CC=C32 |
| IUPAC Name | 3-piperazin-1-yl-1,2-benzothiazole |
| InChI Key | KRDOFMHJLWKXIU-UHFFFAOYSA-N |
| Molecular Formula | C11H13N3S |
Psoralen 99.0+%, TCI America™
CAS: 66-97-7 Molecular Formula: C11H6O3 Molecular Weight (g/mol): 186.17 MDL Number: MFCD00010520 InChI Key: ZCCUUQDIBDJBTK-UHFFFAOYSA-N Synonym: psoralen,ficusin,7h-furo 3,2-g chromen-7-one,furocoumarin,psoralene,7h-furo 3,2-g 1 benzopyran-7-one,psorline-p,6,7-furanocoumarin,furo 3,2-g chromen-7-one,furo 3,2-g coumarin PubChem CID: 6199 ChEBI: CHEBI:27616 IUPAC Name: 7H-furo[3,2-g]chromen-7-one SMILES: O=C1OC2=CC3=C(C=CO3)C=C2C=C1
| PubChem CID | 6199 |
|---|---|
| CAS | 66-97-7 |
| Molecular Weight (g/mol) | 186.17 |
| ChEBI | CHEBI:27616 |
| MDL Number | MFCD00010520 |
| SMILES | O=C1OC2=CC3=C(C=CO3)C=C2C=C1 |
| Synonym | psoralen,ficusin,7h-furo 3,2-g chromen-7-one,furocoumarin,psoralene,7h-furo 3,2-g 1 benzopyran-7-one,psorline-p,6,7-furanocoumarin,furo 3,2-g chromen-7-one,furo 3,2-g coumarin |
| IUPAC Name | 7H-furo[3,2-g]chromen-7-one |
| InChI Key | ZCCUUQDIBDJBTK-UHFFFAOYSA-N |
| Molecular Formula | C11H6O3 |
3-(4-Piperidyl)indole 98.0+%, TCI America™
CAS: 17403-09-7 Molecular Formula: C13H17N2 Molecular Weight (g/mol): 201.29 MDL Number: MFCD01764670 InChI Key: KAIRZPVWWIMPFT-UHFFFAOYSA-O Synonym: 3-piperidin-4-yl-1h-indole,3-4-piperidyl-1h-indole,3-4-piperidyl indole,3-4-piperidinyl-1h-indole,4-3-indolyl piperidine,4-3-indo piperidine,3-piperid-4-yl indole,4-1h-indol-3-yl piperidine,1h-indole,3-4-piperidinyl,peakdale1_002265 PubChem CID: 702235 IUPAC Name: 4-(1H-indol-3-yl)piperidin-1-ium SMILES: C1CC(CC[NH2+]1)C1=CNC2=CC=CC=C12
| PubChem CID | 702235 |
|---|---|
| CAS | 17403-09-7 |
| Molecular Weight (g/mol) | 201.29 |
| MDL Number | MFCD01764670 |
| SMILES | C1CC(CC[NH2+]1)C1=CNC2=CC=CC=C12 |
| Synonym | 3-piperidin-4-yl-1h-indole,3-4-piperidyl-1h-indole,3-4-piperidyl indole,3-4-piperidinyl-1h-indole,4-3-indolyl piperidine,4-3-indo piperidine,3-piperid-4-yl indole,4-1h-indol-3-yl piperidine,1h-indole,3-4-piperidinyl,peakdale1_002265 |
| IUPAC Name | 4-(1H-indol-3-yl)piperidin-1-ium |
| InChI Key | KAIRZPVWWIMPFT-UHFFFAOYSA-O |
| Molecular Formula | C13H17N2 |