Vitas-M small molecule compound

methyl 11-(2,5-dimethoxyphenyl)-3-methyl-1-oxo-2,3,4,5,10,11-hexahydro-1H-dibenzo[b,e][1,4]diazepine-2-carboxylate

Catalog ID
STK403700
SMILES COc1ccc(c(c1)C1Nc2ccccc2NC2=C1C(=O)C(C(C2)C)C(=O)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 C24H26N2O5 MW 422.48 g/mol Purity >90% as per NMR
InChI
InChI=1S/C24H26N2O5/c1-13-11-18-21(23(27)20(13)24(28)31-4)22(26-17-8-6-5-7-16(17)25-18)15-12-14(29-2)9-10-19(15)30-3/h5-10,12-13,20,22,25-26H,11H2,1-4H3
InChIKey
AZSRKVIHKAFTKV-UHFFFAOYSA-N
Synonyms

CC1CC2=C(C(NC3=CC=CC=C3N2)C4=C(C=CC(=C4)OC)OC)C(=O)C1C(=O)OC
InChI=1SC24H26N2O5c113111821(23(27)20(13)24(28)314)22(2617865716(17)2518)151214(292)91019(15)303h510121320222526H11H214H3
methyl11(25dimethoxyphenyl)3methyl1oxo23451011hexahydro1Hdibenzo(be)(14)diazepine2carboxylate
methyl6(25dimethoxyphenyl)9methyl7oxo56891011hexahydrobenzo(b)(14)benzodiazepine8carboxylate
MFCD03632418
ZINC000000815898
ZINC000229944300

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Available files

Download the SDF, MOL, 3D structure and SDS documents from Vitas-M.