Vitas-M small molecule compound

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

Catalog ID
STL438753
SMILES COc1ccc(cc1OC)C1C2=C(CC(CC2=O)c2ccc(cc2)C)Nc2c(N1C(=O)c1ccccc1)cccc2

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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)26-19-28-33(30(38)20-26)34(25-17-18-31(40-2)32(21-25)41-3)37(29-12-8-7-11-27(29)36-28)35(39)24-9-5-4-6-10-24/h4-18,21,26,34,36H,19-20H2,1-3H3
InChIKey
KFGVICPIJUBQSK-UHFFFAOYSA-N
Synonyms

11(34dimethoxyphenyl)3(4methylphenyl)10(phenylcarbonyl)23451011hexahydro1Hdibenzo(be)(14)diazepin1one
5benzoyl6(34dimethoxyphenyl)9(4methylphenyl)891011tetrahydro6Hbenzo(b)(14)benzodiazepin7one
CC1=CC=C(C=C1)C2CC3=C(C(N(C4=CC=CC=C4N3)C(=O)C5=CC=CC=C5)C6=CC(=C(C=C6)OC)OC)C(=O)C2
InChI=1SC35H32N2O4c122131523(161422)26192833(30(38)2026)34(25171831(402)32(2125)413)37(2912871127(29)3628)35(39)2495461024h41821263436H1920H213H3
MFCD06244668
ZINC000001409626
ZINC000001409629

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Available files

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