Vitas-M small molecule compound

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

Catalog ID
STK136213
SMILES CCCCCC(=O)N1c2ccccc2NC2=C(C1c1cccc(c1OC)OC)C(=O)CC(C2)(C)C

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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 C29H36N2O4 MW 476.62 g/mol Purity >90% as per NMR
InChI
InChI=1S/C29H36N2O4/c1-6-7-8-16-25(33)31-22-14-10-9-13-20(22)30-21-17-29(2,3)18-23(32)26(21)27(31)19-12-11-15-24(34-4)28(19)35-5/h9-15,27,30H,6-8,16-18H2,1-5H3
InChIKey
MNBZTUNTSGRTLI-UHFFFAOYSA-N
Synonyms
401462-71-3
11(23dimethoxyphenyl)10hexanoyl33dimethyl23451011hexahydro1Hdibenzo(be)(14)diazepin1one
401462713
6(23dimethoxyphenyl)5hexanoyl99dimethyl681011tetrahydrobenzo(b)(14)benzodiazepin7one
CCCCCC(=O)N1C(C2=C(CC(CC2=O)(C)C)NC3=CC=CC=C31)C4=C(C(=CC=C4)OC)OC
InChI=1SC29H36N2O4c16781625(33)3122141091320(22)30211729(23)1823(32)26(21)27(31)1912111524(344)28(19)355h9152730H681618H215H3
MFCD01921827
ZINC000018182024
ZINC000018182027

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Available files

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