Vitas-M small molecule compound
11-(4-hydroxy-3-methoxyphenyl)-3-phenyl-7-(phenylcarbonyl)-2,3,4,5,10,11-hexahydro-1H-dibenzo[b,e][1,4]diazepin-1-one
Catalog ID
STK077140
SMILES COc1cc(ccc1O)C1Nc2ccc(cc2NC2=C1C(=O)CC(C2)c1ccccc1)C(=O)c1ccccc1
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We supply compounds in quantities from 1 mg up to 5 g for research and development purposes only.
We do not supply quantities above 5 g.
Structure and other identifiers
2D representation rendered from the SMILES, with core physicochemical data.Formula C33H28N2O4 MW 516.60 g/mol Purity >90% as per NMR
InChI
InChI=1S/C33H28N2O4/c1-39-30-19-22(13-15-28(30)36)32-31-27(17-24(18-29(31)37)20-8-4-2-5-9-20)34-26-16-23(12-14-25(26)35-32)33(38)21-10-6-3-7-11-21/h2-16,19,24,32,34-36H,17-18H2,1H3InChIKey
UCZITECQZOFINN-UHFFFAOYSA-NSynonyms
6085-27-411(4hydroxy3methoxyphenyl)3phenyl7(phenylcarbonyl)23451011hexahydro1Hdibenzo(be)(14)diazepin1one
2benzoyl6(4hydroxy3methoxyphenyl)9phenyl56891011hexahydrobenzo(b)(14)benzodiazepin7one
6085274
COC1=C(C=CC(=C1)C2C3=C(CC(CC3=O)C4=CC=CC=C4)NC5=C(N2)C=CC(=C5)C(=O)C6=CC=CC=C6)O
COc1cc(ccc1O)C1Nc2ccc(cc2NC2=C1C(=O)CC(C2)c1ccccc1)C(=O)c1ccccc1
InChI=1SC33H28N2O4c139301922(131528(30)36)323127(1724(1829(31)37)208425920)34261623(121425(26)3532)33(38)21106371121h2161924323436H1718H21H3
MFCD02634714
STK077140
ZINC000009635919
ZINC000009635922
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