Vitas-M small molecule compound

3-(4-methoxyphenyl)-11-(2-methylphenyl)-2,3,4,5,10,11-hexahydro-1H-dibenzo[b,e][1,4]diazepin-1-one

Catalog ID
STK079489
SMILES COc1ccc(cc1)C1CC(=O)C2=C(C1)Nc1ccccc1NC2c1ccccc1C

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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 C27H26N2O2 MW 410.52 g/mol Purity >90% as per NMR
InChI
InChI=1S/C27H26N2O2/c1-17-7-3-4-8-21(17)27-26-24(28-22-9-5-6-10-23(22)29-27)15-19(16-25(26)30)18-11-13-20(31-2)14-12-18/h3-14,19,27-29H,15-16H2,1-2H3
InChIKey
SWSXFSJYSUMBBG-UHFFFAOYSA-N
Synonyms
312622-36-9
3(4methoxyphenyl)11(2methylphenyl)23451011hexahydro1Hdibenzo(be)(14)diazepin1one
312622369
9(4methoxyphenyl)6(2methylphenyl)56891011hexahydrobenzo(b)(14)benzodiazepin7one
CC1=CC=CC=C1C2C3=C(CC(CC3=O)C4=CC=C(C=C4)OC)NC5=CC=CC=C5N2
COc1ccc(cc1)C1CC(=O)C2=C(C1)Nc1ccccc1NC2c1ccccc1C
InChI=1SC27H26N2O2c117734821(17)272624(28229561023(22)2927)1519(1625(26)30)18111320(312)141218h314192729H1516H212H3
MFCD01825172
STK079489
ZINC000000681780
ZINC000000681783

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Available files

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