Vitas-M small molecule compound
11-[2-(benzyloxy)phenyl]-3-(3,4,5-trimethoxyphenyl)-2,3,4,5,10,11-hexahydro-1H-dibenzo[b,e][1,4]diazepin-1-one
Catalog ID
STK403405
SMILES COc1c(OC)cc(cc1OC)C1CC(=O)C2=C(C1)Nc1ccccc1NC2c1ccccc1OCc1ccccc1
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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 C35H34N2O5 MW 562.67 g/mol Purity >90% as per NMR
InChI
InChI=1S/C35H34N2O5/c1-39-31-19-24(20-32(40-2)35(31)41-3)23-17-28-33(29(38)18-23)34(37-27-15-9-8-14-26(27)36-28)25-13-7-10-16-30(25)42-21-22-11-5-4-6-12-22/h4-16,19-20,23,34,36-37H,17-18,21H2,1-3H3InChIKey
SJBYNNBZRQSUQG-UHFFFAOYSA-NSynonyms
11(2(benzyloxy)phenyl)3(345trimethoxyphenyl)23451011hexahydro1Hdibenzo(be)(14)diazepin1one
6(2phenylmethoxyphenyl)9(345trimethoxyphenyl)56891011hexahydrobenzo(b)(14)benzodiazepin7one
COC1=CC(=CC(=C1OC)OC)C2CC3=C(C(NC4=CC=CC=C4N3)C5=CC=CC=C5OCC6=CC=CC=C6)C(=O)C2
InChI=1SC35H34N2O5c139311924(2032(402)35(31)413)23172833(29(38)1823)34(372715981426(27)3628)25137101630(25)422122115461222h416192023343637H171821H213H3
MFCD03489231
ZINC000053262024
ZINC000053262032
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