Organoheterocyclic compounds
2-Phenylbenzimidazole, 97%
CAS: 716-79-0 Molecular Formula: C13H10N2 Molecular Weight (g/mol): 194.24 MDL Number: MFCD00005592 InChI Key: DWYHDSLIWMUSOO-UHFFFAOYSA-N Synonym: 2-phenylbenzimidazole,2-phenyl-1h-benzo d imidazole,phenizidole,phenzidole,phenzidol,gainex,1h-benzimidazole, 2-phenyl,benzimidazole, 2-phenyl,2-phenylbenzimdazole,2-phenyl-1h-benzoimidazole PubChem CID: 12855 SMILES: N1C2=CC=CC=C2N=C1C1=CC=CC=C1
1-Benzyloxycarbonyl-1,2,3,6-tetrahydropyridine-4-boronic acid pinacol ester, 98%, Thermo Scientific Chemicals
CAS: 286961-15-7 Molecular Formula: C19H26BNO4 Molecular Weight (g/mol): 343.23 MDL Number: MFCD11521562 InChI Key: QDSFHRPYZPQWEJ-UHFFFAOYSA-N Synonym: benzyl 4-4,4,5,5-tetramethyl-1,3,2-dioxaborolan-2-yl-5,6-dihydropyridine-1 2h-carboxylate,4-4,4,5,5-tetramethyl-1,3,2 dioxaborolan-2-yl-3,6-dihydro-2h-pyridine-1-carboxylic acid benzyl ester,n-cbz-3,6-dihydro-2h-pyridine-4-boronic acid pinacol ester,benzyl 4-4,4,5,5-tetramethyl-1,3,2-dioxaborolan-2-yl-3,6-dihydro-2h-pyridine-1-carboxylate,1-benzyloxycarbonyl-1,2,3,6-tetrahydropyridine-4-boronic acid pinacol ester,benzyl 4-4,4,5,5-tetramethyl-1,3,2-dioxaborolan-2-yl-3,6-dihydropyridine-1 2h-carboxylate,benzyl 5,6-dihydro-4-4,4,5,5-tetramethyl-1,3,2-dioxaborolan-2-yl pyridine-1 2h-carboxylate,n-cbz-1,2,3,6-tetrahydropyridine-4-boronic acid pinacol ester,benzyl 4-tetramethyl-1,3,2-dioxaborolan-2-yl-3,6-dihydro-2h-pyridine-1-carboxylate,benzyl 4-4,4,5,5-tetrameth PubChem CID: 11290836 IUPAC Name: benzyl 4-(4,4,5,5-tetramethyl-1,3,2-dioxaborolan-2-yl)-3,6-dihydro-2H-pyridine-1-carboxylate SMILES: B1(OC(C(O1)(C)C)(C)C)C2=CCN(CC2)C(=O)OCC3=CC=CC=C3
4,5',8-Trimethylpsoralen, 99%
CAS: 3902-71-4 Molecular Formula: C14H12O3 Molecular Weight (g/mol): 228.25 MDL Number: MFCD00005010 InChI Key: FMHHVULEAZTJMA-UHFFFAOYSA-N Synonym: trioxsalen,trioxysalen,trisoralen,trimethylpsoralen,4,5',8-trimethylpsoralen,elder 8011,trioxisaleno,trioxysalene,trioxysalenum,2',4,8-trimethylpsoralen PubChem CID: 5585 ChEBI: CHEBI:28329 IUPAC Name: 2,5,9-trimethyl-7H-furo[3,2-g]chromen-7-one SMILES: CC1=CC2=CC3=C(OC(=O)C=C3C)C(C)=C2O1
4-(2-Methyl-1H-imidazol-1-yl)benzylamine, 90%, Thermo Scientific™
CAS: 883291-45-0 Molecular Formula: C11H13N3 Molecular Weight (g/mol): 187.246 MDL Number: MFCD06617944 InChI Key: JOMOQABDRBJMDQ-UHFFFAOYSA-N Synonym: 4-2-methyl-1h-imidazol-1-yl benzylamine,1-4-2-methyl-1h-imidazol-1-yl phenyl methanamine,4-2-methylimidazol-1-yl phenyl methanamine,benzenemethanamine,4-2-methyl-1h-imidazol-1-yl,4-2-methyl-1h-imidazol-1-yl phenyl methanamine,4-2-methylimidazolyl phenyl methylamine,1-4-2-methylimidazol-1-yl phenyl methanamine PubChem CID: 4913134 IUPAC Name: [4-(2-methylimidazol-1-yl)phenyl]methanamine SMILES: CC1=NC=CN1C2=CC=C(C=C2)CN
6-(Trifluoromethyl)nicotinic acid, 97%
CAS: 231291-22-8 Molecular Formula: C7H3F3NO2 Molecular Weight (g/mol): 190.10 MDL Number: MFCD00792430 InChI Key: JNYLMODTPLSLIF-UHFFFAOYSA-M Synonym: 6-trifluoromethyl nicotinic acid,6-trifluoromethyl pyridine-3-carboxylic acid,6-trifluoromethylnicotinic acid,6-trifluoromethyl-nicotinic acid,2-trifluoromethyl-5-pyridinecarboxylic acid,3-pyridinecarboxylic acid, 6-trifluoromethyl,2-trifluoromethyl pyridine-5-carboxylic acid,6-trifluoromethyl-3-pyridinecarboxylic acid PubChem CID: 2777551 IUPAC Name: 6-(trifluoromethyl)pyridine-3-carboxylic acid SMILES: [O-]C(=O)C1=CC=C(N=C1)C(F)(F)F
2,6-Di-tert-butyl-4-methylpyridine, 97%
CAS: 38222-83-2 Molecular Formula: C14H23N Molecular Weight (g/mol): 205.35 MDL Number: MFCD00006305 InChI Key: HVHZEKKZMFRULH-UHFFFAOYSA-N Synonym: 2,6-di-tert-butyl-4-methylpyridine,dtbmp,pyridine, 2,6-bis 1,1-dimethylethyl-4-methyl,2,6-di-t-butyl-4-methylpyridine,2,6-ditert-butyl-4-methyl-pyridine,2,6-bis tert-butyl-4-methylpyridine,pubchem10244,acmc-209iyr,ksc490s2n,2,6-di-t-butyl 4-methylpyridine PubChem CID: 98898 SMILES: CC1=CC(=NC(=C1)C(C)(C)C)C(C)(C)C
Ketoconazole, 98%
CAS: 65277-42-1 Molecular Formula: C26H28Cl2N4O4 Molecular Weight (g/mol): 534.452 MDL Number: MFCD00058579 InChI Key: XMAYWYJOQHXEEK-SIULDFEJSA-N Synonym: ketoconazole PubChem CID: 76973198 IUPAC Name: 2,2,2-trideuterio-1-[4-[4-[[(2R,4S)-2-(2,4-dichlorophenyl)-2-(imidazol-1-ylmethyl)-1,3-dioxolan-4-yl]methoxy]phenyl]piperazin-1-yl]ethanone SMILES: CC(=O)N1CCN(CC1)C2=CC=C(C=C2)OCC3COC(O3)(CN4C=CN=C4)C5=C(C=C(C=C5)Cl)Cl
Thermo Scientific Chemicals 2'-O-Methyluridine, 99%
CAS: 2140-76-3 Molecular Formula: C10H14N2O6 Molecular Weight (g/mol): 258.23 MDL Number: MFCD00056054 InChI Key: SXUXMRMBWZCMEN-ZOQUXTDFSA-N Synonym: 2'-o-methyluridine,uridine, 2'-o-methyl,1-2r,3r,4r,5r-4-hydroxy-5-hydroxymethyl-3-methoxytetrahydrofuran-2-yl pyrimidine-2,4 1h,3h-dione,o 2'-methyluridine,2-o-methyluridine,2'-o-methyl uridine,unii-399vzb6tmb,399vzb6tmb,2'-o-methyl-uridine,um PubChem CID: 102212 ChEBI: CHEBI:19227 IUPAC Name: 1-[(2R,3R,4R,5R)-4-hydroxy-5-(hydroxymethyl)-3-methoxyoxolan-2-yl]pyrimidine-2,4-dione SMILES: COC1C(C(OC1N2C=CC(=O)NC2=O)CO)O
N-Succinimidyl 3-(propargyloxy)propionate
CAS: 1174157-65-3 Molecular Formula: C10H11NO5 Molecular Weight (g/mol): 225.20 MDL Number: MFCD13184973 InChI Key: WKIKHHMUNOVQLD-UHFFFAOYSA-N Synonym: n-succinimidyl 3-propargyloxy propionate,propargyl-nhs,ambotzpeg1935,acetylene-peg-nhs ester,propargyl-peg1-nhs ester,propargyl-succinimidyl-ester,propargyl-n-hydroxysuccinimidyl ester,2,5-dioxopyrrolidin-1-yl 3-prop-2-ynyloxy propanoate,2,5-dioxopyrrolidin-1-yl 3-prop-2-yn-1-yloxy propanoate PubChem CID: 51340986 IUPAC Name: 2,5-dioxopyrrolidin-1-yl 3-(prop-2-yn-1-yloxy)propanoate SMILES: O=C(CCOCC#C)ON1C(=O)CCC1=O
Acemetacin
CAS: 53164-05-9 Molecular Formula: C21H18ClNO6 Molecular Weight (g/mol): 415.826 MDL Number: MFCD00151473 InChI Key: FSQKKOOTNAMONP-UHFFFAOYSA-N Synonym: acemetacin,rantudil,emflex,acemetacinum,acemix,acemetacina,acemetacine,aximeixin,rheumibis,indomethacin carboxymethyl ester PubChem CID: 1981 ChEBI: CHEBI:31162 IUPAC Name: 2-[2-[1-(4-chlorobenzoyl)-5-methoxy-2-methylindol-3-yl]acetyl]oxyacetic acid SMILES: CC1=C(C2=C(N1C(=O)C3=CC=C(C=C3)Cl)C=CC(=C2)OC)CC(=O)OCC(=O)O
Tetrahydropalmatine, 98%
CAS: 2934-97-6 Molecular Formula: C21H25NO4 Molecular Weight (g/mol): 355.434 MDL Number: MFCD00214191 InChI Key: AEQDJSLRWYMAQI-UHFFFAOYSA-N Synonym: tetrahydropalmatine,rotundine,tetrahydropalmatin,rotundinum,2,3,9,10-tetramethoxy-5,8,13,13a-tetrahydro-6h-isoquino 3,2-a isoquinoline,corydalis b,6h-dibenzo a,g quinolizine, 5,8,13,13a-tetrahydro-2,3,9,10-tetramethoxy,gnf-pf-3943,tetrahydropalmatine hydrochloride,2,3,9,10-tetramethoxy-6,8,13,13a-tetrahydro-5h-isoquinolino 2,1-b isoquinoline PubChem CID: 5417 IUPAC Name: 2,3,9,10-tetramethoxy-6,8,13,13a-tetrahydro-5H-isoquinolino[2,1-b]isoquinoline SMILES: COC1=C(C2=C(CC3C4=CC(=C(C=C4CCN3C2)OC)OC)C=C1)OC
2-Bromo-5-chloropyridine, 98%
CAS: 40473-01-6 Molecular Formula: C5H3BrClN Molecular Weight (g/mol): 192.44 MDL Number: MFCD00234006 InChI Key: BZUUVQCSPHPUQA-UHFFFAOYSA-N Synonym: 5-chloro-2-bromopyridine,2-bromo-5-chloro-pyridine,2-brom-5-chlorpyridin,pyridine, 2-bromo-5-chloro,pubchem1169,acmc-209jeb,2-bromo-5-chloro pyridine,ksc238i0d,tpc-py102,2-bromanyl-5-chloranyl-pyridine PubChem CID: 817098 IUPAC Name: 2-bromo-5-chloropyridine SMILES: C1=CC(=NC=C1Cl)Br
2-Chloro-4,6-dimethylpyridine, 98+%
CAS: 30838-93-8 Molecular Formula: C7H8ClN Molecular Weight (g/mol): 141.60 MDL Number: MFCD08277279 InChI Key: COVGXNSRDOYAJD-UHFFFAOYSA-N Synonym: 2-chloro-4,6-dimethyl pyridine,2-chloro-4,6-dimethyl-pyridine,pyridine, 2-chloro-4,6-dimethyl,pubchem3919,acmc-1agqf,ksc495g6l,aebsf hydrochloride; pefabloc sc PubChem CID: 12508378 IUPAC Name: 2-chloro-4,6-dimethylpyridine SMILES: CC1=CC(C)=NC(Cl)=C1
3-Bromopyridine-2-carboxylic acid, 97%
CAS: 30683-23-9 Molecular Formula: C6H4BrNO2 Molecular Weight (g/mol): 202.007 MDL Number: MFCD01320380 InChI Key: KBDIRPOTVAODSA-UHFFFAOYSA-N Synonym: 3-bromopicolinic acid,3-bromo-2-pyridinecarboxylic acid,2-pyridinecarboxylic acid, 3-bromo,3-bromopyridine-2-carboxylicacid,3-bromo-2-pyridine carboxylic acid,3-bromo-pyridine-2-carboxylic acid,pubchem5070,bromopyridine carboxylic,acmc-1cpch,3-bromo-2-picolinic acid PubChem CID: 2050129 IUPAC Name: 3-bromopyridine-2-carboxylic acid SMILES: C1=CC(=C(N=C1)C(=O)O)Br