Vitas-M small molecule compound
11-(4-hydroxy-3-methoxyphenyl)-7-(phenylcarbonyl)-2,3,4,5,10,11-hexahydro-1H-dibenzo[b,e][1,4]diazepin-1-one
Catalog ID
STK086080
SMILES COc1cc(ccc1O)C1Nc2ccc(cc2NC2=C1C(=O)CCC2)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 C27H24N2O4 MW 440.50 g/mol Purity >90% as per NMR
InChI
InChI=1S/C27H24N2O4/c1-33-24-15-17(11-13-22(24)30)26-25-20(8-5-9-23(25)31)28-21-14-18(10-12-19(21)29-26)27(32)16-6-3-2-4-7-16/h2-4,6-7,10-15,26,28-30H,5,8-9H2,1H3InChIKey
SQEHLXZIOVCQDW-UHFFFAOYSA-NSynonyms
297160-47-511(4hydroxy3methoxyphenyl)7(phenylcarbonyl)23451011hexahydro1Hdibenzo(be)(14)diazepin1one
297160475
2benzoyl6(4hydroxy3methoxyphenyl)56891011hexahydrobenzo(b)(14)benzodiazepin7one
COC1=C(C=CC(=C1)C2C3=C(CCCC3=O)NC4=C(N2)C=CC(=C4)C(=O)C5=CC=CC=C5)O
COc1cc(ccc1O)C1Nc2ccc(cc2NC2=C1C(=O)CCC2)C(=O)c1ccccc1
InChI=1SC27H24N2O4c133241517(111322(24)30)262520(85923(25)31)28211418(101219(21)2926)27(32)166324716h24671015262830H589H21H3
MFCD02109804
STK086080
ZINC000009434050
ZINC000009434258
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