Vitas-M small molecule compound
11-(3-fluorophenyl)-3-(3,4,5-trimethoxyphenyl)-10-[(3,4,5-trimethoxyphenyl)carbonyl]-2,3,4,5,10,11-hexahydro-1H-dibenzo[b,e][1,4]diazepin-1-one
Catalog ID
STK135755
SMILES COc1c(OC)cc(cc1OC)C1CC(=O)C2=C(C1)Nc1ccccc1N(C2c1cccc(c1)F)C(=O)c1cc(OC)c(c(c1)OC)OC
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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 C38H37FN2O8 MW 668.72 g/mol Purity >90% as per NMR
InChI
InChI=1S/C38H37FN2O8/c1-44-30-17-23(18-31(45-2)36(30)48-5)22-15-27-34(29(42)16-22)35(21-10-9-11-25(39)14-21)41(28-13-8-7-12-26(28)40-27)38(43)24-19-32(46-3)37(49-6)33(20-24)47-4/h7-14,17-20,22,35,40H,15-16H2,1-6H3InChIKey
SHBHLLGDUVTMBM-UHFFFAOYSA-NSynonyms
11(3fluorophenyl)10(345trimethoxybenzoyl)3(345trimethoxyphenyl)23451011hexahydro1Hdibenzo(be)(14)diazepin1one
11(3fluorophenyl)3(345trimethoxyphenyl)10((345trimethoxyphenyl)carbonyl)23451011hexahydro1Hdibenzo(be)(14)diazepin1one
6(3fluorophenyl)5(345trimethoxybenzoyl)9(345trimethoxyphenyl)891011tetrahydro6Hbenzo(b)(14)benzodiazepin7one
COC1=CC(=CC(=C1OC)OC)C2CC3=C(C(N(C4=CC=CC=C4N3)C(=O)C5=CC(=C(C(=C5)OC)OC)OC)C6=CC(=CC=C6)F)C(=O)C2
InChI=1SC38H37FN2O8c144301723(1831(452)36(30)485)22152734(29(42)1622)35(211091125(39)1421)41(2813871226(28)4027)38(43)241932(463)37(496)33(2024)474h7141720223540H1516H216H3
MFCD02375484
ZINC000033355183
ZINC000033355188
Check stock
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Check stock on Vitas-MAvailable files
Download the SDF, MOL, 3D structure and SDS documents from Vitas-M.