Organoheterocyclic compounds
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1-(2-Pyridyl)piperazine, 99%
CAS: 34803-66-2 Molecular Formula: C9H13N3 Molecular Weight (g/mol): 163.224 MDL Number: MFCD00006216 InChI Key: GZRKXKUVVPSREJ-UHFFFAOYSA-N Synonym: 1-2-pyridyl piperazine,1-pyridin-2-yl piperazine,1-pyridin-2-yl-piperazine,1-2-pyridinyl piperazine,piperazine, 1-2-pyridinyl,2-pyridylpiperazine,pyridinylpiperazine,2-1-piperazinyl pyridine PubChem CID: 94459 IUPAC Name: 1-pyridin-2-ylpiperazine SMILES: C1CN(CCN1)C2=CC=CC=N2
| PubChem CID | 94459 |
|---|---|
| CAS | 34803-66-2 |
| Molecular Weight (g/mol) | 163.224 |
| MDL Number | MFCD00006216 |
| SMILES | C1CN(CCN1)C2=CC=CC=N2 |
| Synonym | 1-2-pyridyl piperazine,1-pyridin-2-yl piperazine,1-pyridin-2-yl-piperazine,1-2-pyridinyl piperazine,piperazine, 1-2-pyridinyl,2-pyridylpiperazine,pyridinylpiperazine,2-1-piperazinyl pyridine |
| IUPAC Name | 1-pyridin-2-ylpiperazine |
| InChI Key | GZRKXKUVVPSREJ-UHFFFAOYSA-N |
| Molecular Formula | C9H13N3 |
1-Boc-indole, 97%
CAS: 75400-67-8 Molecular Formula: C13H15NO2 Molecular Weight (g/mol): 217.27 MDL Number: MFCD02093939 InChI Key: OWPIFQXNMLDXKW-UHFFFAOYSA-N Synonym: 1-boc-indole,tert-butyl 1h-indole-1-carboxylate,n-boc-indole,tert-butyl 1-indolecarboxylate,1h-indole-1-carboxylic acid, 1,1-dimethylethyl ester,1-tert-butoxycarbonyl indole,n-boc indole,pubchem7228,acmc-1bjgd,1-tert-butoxycarbonylindole PubChem CID: 3532980 SMILES: CC(C)(C)OC(=O)N1C=CC2=CC=CC=C12
| PubChem CID | 3532980 |
|---|---|
| CAS | 75400-67-8 |
| Molecular Weight (g/mol) | 217.27 |
| MDL Number | MFCD02093939 |
| SMILES | CC(C)(C)OC(=O)N1C=CC2=CC=CC=C12 |
| Synonym | 1-boc-indole,tert-butyl 1h-indole-1-carboxylate,n-boc-indole,tert-butyl 1-indolecarboxylate,1h-indole-1-carboxylic acid, 1,1-dimethylethyl ester,1-tert-butoxycarbonyl indole,n-boc indole,pubchem7228,acmc-1bjgd,1-tert-butoxycarbonylindole |
| InChI Key | OWPIFQXNMLDXKW-UHFFFAOYSA-N |
| Molecular Formula | C13H15NO2 |
5-Hydroxyindole-3-acetic acid, 98%
CAS: 54-16-0 Molecular Formula: C10H9NO3 Molecular Weight (g/mol): 191.186 MDL Number: MFCD00005639 InChI Key: DUUGKQCEGZLZNO-UHFFFAOYSA-N Synonym: 5-hydroxyindole-3-acetic acid,5-hiaa,2-5-hydroxy-1h-indol-3-yl acetic acid,5-hydroxyindoleacetic acid,5-hydroxyheteroauxin,5-hydroxy-1h-indol-3-yl acetic acid,5-oxyindoleacetic acid,hydroxyindoleacetic acid,5-hydroxy-iaa,5-hydroxyindol-3-ylacetic acid PubChem CID: 1826 ChEBI: CHEBI:27823 IUPAC Name: 2-(5-hydroxy-1H-indol-3-yl)acetic acid SMILES: C1=CC2=C(C=C1O)C(=CN2)CC(=O)O
| PubChem CID | 1826 |
|---|---|
| CAS | 54-16-0 |
| Molecular Weight (g/mol) | 191.186 |
| ChEBI | CHEBI:27823 |
| MDL Number | MFCD00005639 |
| SMILES | C1=CC2=C(C=C1O)C(=CN2)CC(=O)O |
| Synonym | 5-hydroxyindole-3-acetic acid,5-hiaa,2-5-hydroxy-1h-indol-3-yl acetic acid,5-hydroxyindoleacetic acid,5-hydroxyheteroauxin,5-hydroxy-1h-indol-3-yl acetic acid,5-oxyindoleacetic acid,hydroxyindoleacetic acid,5-hydroxy-iaa,5-hydroxyindol-3-ylacetic acid |
| IUPAC Name | 2-(5-hydroxy-1H-indol-3-yl)acetic acid |
| InChI Key | DUUGKQCEGZLZNO-UHFFFAOYSA-N |
| Molecular Formula | C10H9NO3 |
Indole-5-carboxylic acid, 98%
CAS: 1670-81-1 Molecular Formula: C9H6NO2 Molecular Weight (g/mol): 160.15 MDL Number: MFCD00005678 InChI Key: IENZCGNHSIMFJE-UHFFFAOYSA-M Synonym: indole-5-carboxylic acid,5-carboxyindole,5-indolecarboxylic acid,indole-5-carboxylic aicd,pubchem1694,5-carboxy-1h-indole,indole-5-carboxylicacid,indol-5-carboxylic acid,5-indole carboxylic acid,indole 5-carboxylic acid PubChem CID: 74280 IUPAC Name: 1H-indole-5-carboxylic acid SMILES: [O-]C(=O)C1=CC=C2NC=CC2=C1
| PubChem CID | 74280 |
|---|---|
| CAS | 1670-81-1 |
| Molecular Weight (g/mol) | 160.15 |
| MDL Number | MFCD00005678 |
| SMILES | [O-]C(=O)C1=CC=C2NC=CC2=C1 |
| Synonym | indole-5-carboxylic acid,5-carboxyindole,5-indolecarboxylic acid,indole-5-carboxylic aicd,pubchem1694,5-carboxy-1h-indole,indole-5-carboxylicacid,indol-5-carboxylic acid,5-indole carboxylic acid,indole 5-carboxylic acid |
| IUPAC Name | 1H-indole-5-carboxylic acid |
| InChI Key | IENZCGNHSIMFJE-UHFFFAOYSA-M |
| Molecular Formula | C9H6NO2 |
2,3,3,5-Tetramethylindolenine, 94%
CAS: 25981-82-2 Molecular Formula: C12H15N Molecular Weight (g/mol): 173.26 MDL Number: MFCD03093020 InChI Key: RQVAPBRSUHSDGP-UHFFFAOYSA-N Synonym: 2,3,3,5-tetramethyl-3h-indole,2,3,3,5-tetramethylindolenine,3h-indole, 2,3,3,5-tetramethyl,pubchem2092,2,3,3,5-tetramethyl-3h-indol,2,3,3,5-tetramethyl-3-h-indole,3h-indole,2,3,3,5-tetramethyl,2,3,3,5-tetramethyl-3-hydroindole,2,3,3,5-tetramethyl-3-h indole PubChem CID: 117693 IUPAC Name: 2,3,3,5-tetramethylindole SMILES: CC1=NC2=CC=C(C)C=C2C1(C)C
| PubChem CID | 117693 |
|---|---|
| CAS | 25981-82-2 |
| Molecular Weight (g/mol) | 173.26 |
| MDL Number | MFCD03093020 |
| SMILES | CC1=NC2=CC=C(C)C=C2C1(C)C |
| Synonym | 2,3,3,5-tetramethyl-3h-indole,2,3,3,5-tetramethylindolenine,3h-indole, 2,3,3,5-tetramethyl,pubchem2092,2,3,3,5-tetramethyl-3h-indol,2,3,3,5-tetramethyl-3-h-indole,3h-indole,2,3,3,5-tetramethyl,2,3,3,5-tetramethyl-3-hydroindole,2,3,3,5-tetramethyl-3-h indole |
| IUPAC Name | 2,3,3,5-tetramethylindole |
| InChI Key | RQVAPBRSUHSDGP-UHFFFAOYSA-N |
| Molecular Formula | C12H15N |
Bisindolylmaleimide 1, Thermo Scientific Chemicals
CAS: 133052-90-1 Molecular Formula: C25H24N4O2 Molecular Weight (g/mol): 412.493 MDL Number: MFCD00236428 InChI Key: QMGUOJYZJKLOLH-UHFFFAOYSA-N Synonym: bisindolylmaleimide i,unii-l79h6n0v6c,rbt205 inhibitor,gö 6850,bisindolylmaleimide i gf 109203x,bim-1,chembl7463,2-1-3-dimethylaminopropyl indol-3-yl-3-indol-3-yl maleimide,3-1-3-dimethylamino propyl-1h-indol-3-yl-4-1h-indol-3-yl-1h-pyrrole-2,5-dione PubChem CID: 2396 ChEBI: CHEBI:41072 IUPAC Name: 3-[1-[3-(dimethylamino)propyl]indol-3-yl]-4-(1H-indol-3-yl)pyrrole-2,5-dione SMILES: CN(C)CCCN1C=C(C2=CC=CC=C21)C3=C(C(=O)NC3=O)C4=CNC5=CC=CC=C54
| PubChem CID | 2396 |
|---|---|
| CAS | 133052-90-1 |
| Molecular Weight (g/mol) | 412.493 |
| ChEBI | CHEBI:41072 |
| MDL Number | MFCD00236428 |
| SMILES | CN(C)CCCN1C=C(C2=CC=CC=C21)C3=C(C(=O)NC3=O)C4=CNC5=CC=CC=C54 |
| Synonym | bisindolylmaleimide i,unii-l79h6n0v6c,rbt205 inhibitor,gö 6850,bisindolylmaleimide i gf 109203x,bim-1,chembl7463,2-1-3-dimethylaminopropyl indol-3-yl-3-indol-3-yl maleimide,3-1-3-dimethylamino propyl-1h-indol-3-yl-4-1h-indol-3-yl-1h-pyrrole-2,5-dione |
| IUPAC Name | 3-[1-[3-(dimethylamino)propyl]indol-3-yl]-4-(1H-indol-3-yl)pyrrole-2,5-dione |
| InChI Key | QMGUOJYZJKLOLH-UHFFFAOYSA-N |
| Molecular Formula | C25H24N4O2 |
| CAS | 6705-03-9 |
|---|
5-Hydroxyindole, 98+%
CAS: 1953-54-4 Molecular Formula: C8H7NO Molecular Weight (g/mol): 133.15 MDL Number: MFCD00005677 InChI Key: LMIQERWZRIFWNZ-UHFFFAOYSA-N Synonym: 5-hydroxyindole,indol-5-ol,5-hydroxy-1h-indole,hydroxy-5 indole,5-hydroxy-indole,5-indolol,hydroxy-5-indole,5-hydroxyindol,5-hydroxy indole,unii-320un7xzyn PubChem CID: 16054 IUPAC Name: 1H-indol-5-ol SMILES: OC1=CC=C2NC=CC2=C1
| PubChem CID | 16054 |
|---|---|
| CAS | 1953-54-4 |
| Molecular Weight (g/mol) | 133.15 |
| MDL Number | MFCD00005677 |
| SMILES | OC1=CC=C2NC=CC2=C1 |
| Synonym | 5-hydroxyindole,indol-5-ol,5-hydroxy-1h-indole,hydroxy-5 indole,5-hydroxy-indole,5-indolol,hydroxy-5-indole,5-hydroxyindol,5-hydroxy indole,unii-320un7xzyn |
| IUPAC Name | 1H-indol-5-ol |
| InChI Key | LMIQERWZRIFWNZ-UHFFFAOYSA-N |
| Molecular Formula | C8H7NO |
1-(3,6-Dibromo-9H-carbazol-9-yl)-3-(dimethylamino)propan-2-ol, 97%, Thermo Scientific™
CAS: 253449-04-6 Molecular Formula: C17H18Br2N2O Molecular Weight (g/mol): 426.15 MDL Number: MFCD00218393 InChI Key: XUBJEDZHBUPBKL-UHFFFAOYNA-N Synonym: wiskostatin,1-3,6-dibromo-9h-carbazol-9-yl-3-dimethylamino propan-2-ol,1-3,6-dibromocarbazol-9-yl-3-dimethylamino propan-2-ol,maybridge1_002006,1-3,6-dibromo-9-carbazolyl-3-dimethylamino-2-propanol,1-3,6-dibromo-9h-carbazol-9-yl-3-dimethylamino,1-3,6-dibromo-carbazol-9-yl-3-dimethylamino-propan-2-ol,3,6-dibromo-?-dimethylamino methyl-9h-cabazole-9-ethanol,1-3,6-dibromo-9h-carbazol-9-yl-3-dimethylamino propan-2ol,1-3,6-bis bromanyl carbazol-9-yl-3-dimethylamino propan-2-ol PubChem CID: 2775510 ChEBI: CHEBI:78012 SMILES: CN(C)CC(O)CN1C2=C(C=C(Br)C=C2)C2=C1C=CC(Br)=C2
| PubChem CID | 2775510 |
|---|---|
| CAS | 253449-04-6 |
| Molecular Weight (g/mol) | 426.15 |
| ChEBI | CHEBI:78012 |
| MDL Number | MFCD00218393 |
| SMILES | CN(C)CC(O)CN1C2=C(C=C(Br)C=C2)C2=C1C=CC(Br)=C2 |
| Synonym | wiskostatin,1-3,6-dibromo-9h-carbazol-9-yl-3-dimethylamino propan-2-ol,1-3,6-dibromocarbazol-9-yl-3-dimethylamino propan-2-ol,maybridge1_002006,1-3,6-dibromo-9-carbazolyl-3-dimethylamino-2-propanol,1-3,6-dibromo-9h-carbazol-9-yl-3-dimethylamino,1-3,6-dibromo-carbazol-9-yl-3-dimethylamino-propan-2-ol,3,6-dibromo-?-dimethylamino methyl-9h-cabazole-9-ethanol,1-3,6-dibromo-9h-carbazol-9-yl-3-dimethylamino propan-2ol,1-3,6-bis bromanyl carbazol-9-yl-3-dimethylamino propan-2-ol |
| InChI Key | XUBJEDZHBUPBKL-UHFFFAOYNA-N |
| Molecular Formula | C17H18Br2N2O |
Indole-3-Butyric Acid Potassium Salt, MP Biomedicals™
Molecular Formula: C12H12KNO2 Molecular Weight (g/mol): 241.331 MDL Number: MFCD00058442 InChI Key: KTWDHJYSJOSTSJ-UHFFFAOYSA-M Synonym: potassium 4-1h-indol-3-yl butanoate,indole-3-butyric acid potassium salt,indole-3-butyric acid potassium,4-indol-3-ylbutanoic acid, potassium salt,potassium indolebutyrate,pubchem22140,cambridge id 5119461,potassium ion indole-3 butyrate,indole-3-butyric acid-potassium salt,3-indole butyric acid, potassium salt PubChem CID: 23664348 IUPAC Name: potassium;4-(1H-indol-3-yl)butanoate SMILES: C1=CC=C2C(=C1)C(=CN2)CCCC(=O)[O-].[K+]
| PubChem CID | 23664348 |
|---|---|
| Molecular Weight (g/mol) | 241.331 |
| MDL Number | MFCD00058442 |
| SMILES | C1=CC=C2C(=C1)C(=CN2)CCCC(=O)[O-].[K+] |
| Synonym | potassium 4-1h-indol-3-yl butanoate,indole-3-butyric acid potassium salt,indole-3-butyric acid potassium,4-indol-3-ylbutanoic acid, potassium salt,potassium indolebutyrate,pubchem22140,cambridge id 5119461,potassium ion indole-3 butyrate,indole-3-butyric acid-potassium salt,3-indole butyric acid, potassium salt |
| IUPAC Name | potassium;4-(1H-indol-3-yl)butanoate |
| InChI Key | KTWDHJYSJOSTSJ-UHFFFAOYSA-M |
| Molecular Formula | C12H12KNO2 |
Thermo Scientific Chemicals Rizatriptan benzoate
CAS: 145202-66-0 Molecular Formula: C22H25N5O2 Molecular Weight (g/mol): 391.48 InChI Key: JPRXYLQNJJVCMZ-UHFFFAOYSA-N IUPAC Name: benzoic acid; dimethyl(2-{5-[(1H-1,2,4-triazol-1-yl)methyl]-1H-indol-3-yl}ethyl)amine SMILES: OC(=O)C1=CC=CC=C1.CN(C)CCC1=CNC2=CC=C(CN3C=NC=N3)C=C12
| CAS | 145202-66-0 |
|---|---|
| Molecular Weight (g/mol) | 391.48 |
| SMILES | OC(=O)C1=CC=CC=C1.CN(C)CCC1=CNC2=CC=C(CN3C=NC=N3)C=C12 |
| IUPAC Name | benzoic acid; dimethyl(2-{5-[(1H-1,2,4-triazol-1-yl)methyl]-1H-indol-3-yl}ethyl)amine |
| InChI Key | JPRXYLQNJJVCMZ-UHFFFAOYSA-N |
| Molecular Formula | C22H25N5O2 |
Indole-3-butyric Acid, 97%, Spectrum™ Chemical
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CAS: 133-32-4
| CAS | 133-32-4 |
|---|
3-(1-Piperazinylmethyl)indole, 95%
CAS: 114746-66-6 Molecular Formula: C13H17N3 Molecular Weight (g/mol): 215.3 InChI Key: ZTNAIHGOFCMOPJ-UHFFFAOYSA-N Synonym: 3-piperazin-1-ylmethyl-1h-indole,1h-indole,3-1-piperazinylmethyl,acmc-1c6nr,1-1h-indole-3-ylmethyl piperazine,1h-indole, 3-1-piperazinylmethyl-, hydrochloride PubChem CID: 17880880 IUPAC Name: 3-(piperazin-1-ylmethyl)-1H-indole SMILES: C1CN(CCN1)CC2=CNC3=CC=CC=C32
| PubChem CID | 17880880 |
|---|---|
| CAS | 114746-66-6 |
| Molecular Weight (g/mol) | 215.3 |
| SMILES | C1CN(CCN1)CC2=CNC3=CC=CC=C32 |
| Synonym | 3-piperazin-1-ylmethyl-1h-indole,1h-indole,3-1-piperazinylmethyl,acmc-1c6nr,1-1h-indole-3-ylmethyl piperazine,1h-indole, 3-1-piperazinylmethyl-, hydrochloride |
| IUPAC Name | 3-(piperazin-1-ylmethyl)-1H-indole |
| InChI Key | ZTNAIHGOFCMOPJ-UHFFFAOYSA-N |
| Molecular Formula | C13H17N3 |
9-(4-Aminophenyl)carbazole hydrochloride, 98%
CAS: 312700-07-5 Molecular Formula: C18H15ClN2 Molecular Weight (g/mol): 294.782 MDL Number: MFCD00082678 InChI Key: CFQROJKMLJRSAL-UHFFFAOYSA-N Synonym: 4-9h-carbazol-9-yl aniline hydrochloride,9-4-aminophenyl carbazole hydrochloride,4-carbazol-9-yl aniline hydrochloride,4-carbazol-9-ylaniline hydrochloride,acmc-1agoy PubChem CID: 2794996 IUPAC Name: 4-carbazol-9-ylaniline;hydrochloride SMILES: C1=CC=C2C(=C1)C3=CC=CC=C3N2C4=CC=C(C=C4)N.Cl
| PubChem CID | 2794996 |
|---|---|
| CAS | 312700-07-5 |
| Molecular Weight (g/mol) | 294.782 |
| MDL Number | MFCD00082678 |
| SMILES | C1=CC=C2C(=C1)C3=CC=CC=C3N2C4=CC=C(C=C4)N.Cl |
| Synonym | 4-9h-carbazol-9-yl aniline hydrochloride,9-4-aminophenyl carbazole hydrochloride,4-carbazol-9-yl aniline hydrochloride,4-carbazol-9-ylaniline hydrochloride,acmc-1agoy |
| IUPAC Name | 4-carbazol-9-ylaniline;hydrochloride |
| InChI Key | CFQROJKMLJRSAL-UHFFFAOYSA-N |
| Molecular Formula | C18H15ClN2 |
Topiramate, 98%
CAS: 97240-79-4 Molecular Formula: C12H21NO8S Molecular Weight (g/mol): 339.36 InChI Key: KJADKKWYZYXHBB-XBWDGYHZSA-N Synonym: topiramate,topamax,epitomax,topamax sprinkle,tipiramate,topiramatum,tipiramato,topiramato,tipiramate french,tipiramato spanish PubChem CID: 5284627 ChEBI: CHEBI:63631 IUPAC Name: [(3aS,5aR,8aR,8bS)-2,2,7,7-tetramethyl-5,5a,8a,8b-tetrahydrodi[1,3]dioxolo[4,5-a SMILES: CC1(OC2COC3(C(C2O1)OC(O3)(C)C)COS(=O)(=O)N)C
| PubChem CID | 5284627 |
|---|---|
| CAS | 97240-79-4 |
| Molecular Weight (g/mol) | 339.36 |
| ChEBI | CHEBI:63631 |
| SMILES | CC1(OC2COC3(C(C2O1)OC(O3)(C)C)COS(=O)(=O)N)C |
| Synonym | topiramate,topamax,epitomax,topamax sprinkle,tipiramate,topiramatum,tipiramato,topiramato,tipiramate french,tipiramato spanish |
| IUPAC Name | [(3aS,5aR,8aR,8bS)-2,2,7,7-tetramethyl-5,5a,8a,8b-tetrahydrodi[1,3]dioxolo[4,5-a |
| InChI Key | KJADKKWYZYXHBB-XBWDGYHZSA-N |
| Molecular Formula | C12H21NO8S |