Vitas-M small molecule compound
11-(3-hydroxy-4-methoxyphenyl)-7-(phenylcarbonyl)-2,3,4,5,10,11-hexahydro-1H-dibenzo[b,e][1,4]diazepin-1-one
Catalog ID
STK066489
SMILES COc1ccc(cc1O)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/c1-33-24-13-11-17(15-23(24)31)26-25-20(8-5-9-22(25)30)28-21-14-18(10-12-19(21)29-26)27(32)16-6-3-2-4-7-16/h2-4,6-7,10-15,26,28-29,31H,5,8-9H2,1H3InChIKey
TUOCHJKUFIMDRA-UHFFFAOYSA-NSynonyms
11(3hydroxy4methoxyphenyl)7(phenylcarbonyl)23451011hexahydro1Hdibenzo(be)(14)diazepin1one
2benzoyl6(3hydroxy4methoxyphenyl)56891011hexahydrobenzo(b)(14)benzodiazepin7one
COC1=C(C=C(C=C1)C2C3=C(CCCC3=O)NC4=C(N2)C=CC(=C4)C(=O)C5=CC=CC=C5)O
COc1ccc(cc1O)C1Nc2ccc(cc2NC2=C1C(=O)CCC2)C(=O)c1ccccc1
InChI=1SC27H24N2O4c13324131117(1523(24)31)262520(85922(25)30)28211418(101219(21)2926)27(32)166324716h2467101526282931H589H21H3
MFCD03712556
STK066489
ZINC000000795659
ZINC000000795660
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