Vitas-M small molecule compound
3-(3,4-dimethoxyphenyl)-11-(4-methylphenyl)-10-(phenylcarbonyl)-2,3,4,5,10,11-hexahydro-1H-dibenzo[b,e][1,4]diazepin-1-one
Catalog ID
STK742002
SMILES COc1cc(ccc1OC)C1CC(=O)C2=C(C1)Nc1ccccc1N(C2c1ccc(cc1)C)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 C35H32N2O4 MW 544.65 g/mol Purity >90% as per NMR
InChI
InChI=1S/C35H32N2O4/c1-22-13-15-23(16-14-22)34-33-28(19-26(20-30(33)38)25-17-18-31(40-2)32(21-25)41-3)36-27-11-7-8-12-29(27)37(34)35(39)24-9-5-4-6-10-24/h4-18,21,26,34,36H,19-20H2,1-3H3InChIKey
QXTHUCWQQGHXBX-UHFFFAOYSA-NSynonyms
10benzoyl3(34dimethoxyphenyl)11(ptolyl)23451011hexahydro1Hdibenzo(be)(14)diazepin1one
3(34dimethoxyphenyl)11(4methylphenyl)10(phenylcarbonyl)23451011hexahydro1Hdibenzo(be)(14)diazepin1one
5benzoyl9(34dimethoxyphenyl)6(4methylphenyl)891011tetrahydro6Hbenzo(b)(14)benzodiazepin7one
CC1=CC=C(C=C1)C2C3=C(CC(CC3=O)C4=CC(=C(C=C4)OC)OC)NC5=CC=CC=C5N2C(=O)C6=CC=CC=C6
InChI=1SC35H32N2O4c122131523(161422)343328(1926(2030(33)38)25171831(402)32(2125)413)362711781229(27)37(34)35(39)2495461024h41821263436H1920H213H3
MFCD02139784
ZINC000008432179
ZINC000008432183
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