Vitas-M small molecule compound
methyl 11-[4-(benzyloxy)phenyl]-3-methyl-1-oxo-2,3,4,5,10,11-hexahydro-1H-dibenzo[b,e][1,4]diazepine-2-carboxylate
Catalog ID
STK403701
SMILES COC(=O)C1C(C)CC2=C(C1=O)C(Nc1c(N2)cccc1)c1ccc(cc1)OCc1ccccc1
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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 C29H28N2O4 MW 468.55 g/mol Purity >90% as per NMR
InChI
InChI=1S/C29H28N2O4/c1-18-16-24-26(28(32)25(18)29(33)34-2)27(31-23-11-7-6-10-22(23)30-24)20-12-14-21(15-13-20)35-17-19-8-4-3-5-9-19/h3-15,18,25,27,30-31H,16-17H2,1-2H3InChIKey
VBSARBPPMGRIJZ-UHFFFAOYSA-NSynonyms
CC1CC2=C(C(NC3=CC=CC=C3N2)C4=CC=C(C=C4)OCC5=CC=CC=C5)C(=O)C1C(=O)OC
InChI=1SC29H28N2O4c118162426(28(32)25(18)29(33)342)27(312311761022(23)3024)20121421(151320)3517198435919h3151825273031H1617H212H3
methyl11(4(benzyloxy)phenyl)3methyl1oxo23451011hexahydro1Hdibenzo(be)(14)diazepine2carboxylate
methyl9methyl7oxo6(4phenylmethoxyphenyl)56891011hexahydrobenzo(b)(14)benzodiazepine8carboxylate
MFCD03632419
ZINC000015304302
ZINC000102555547
Check stock
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Check stock on Vitas-MAvailable files
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