Vitas-M small molecule compound

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

Catalog ID
STK038063
SMILES O=C1CC(C)(C)CC2=C1C(c1cccnc1)N(c1c(N2)cccc1)C(=O)c1ccccc1

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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 C27H25N3O2 MW 423.51 g/mol Purity >90% as per NMR
InChI
InChI=1S/C27H25N3O2/c1-27(2)15-21-24(23(31)16-27)25(19-11-8-14-28-17-19)30(22-13-7-6-12-20(22)29-21)26(32)18-9-4-3-5-10-18/h3-14,17,25,29H,15-16H2,1-2H3
InChIKey
NFVNFMVMSMSAPQ-UHFFFAOYSA-N
Synonyms
332898-49-4
10benzoyl33dimethyl11(pyridin3yl)23451011hexahydro1Hdibenzo(be)(14)diazepin1one
332898494
33dimethyl10(phenylcarbonyl)11(pyridin3yl)23451011hexahydro1Hdibenzo(be)(14)diazepin1one
5benzoyl99dimethyl6pyridin3yl681011tetrahydrobenzo(b)(14)benzodiazepin7one
CC1(CC2=C(C(N(C3=CC=CC=C3N2)C(=O)C4=CC=CC=C4)C5=CN=CC=C5)C(=O)C1)C
InChI=1SC27H25N3O2c127(2)152124(23(31)1627)25(1911814281719)30(2213761220(22)2921)26(32)1894351018h314172529H1516H212H3
MFCD01810953
O=C1CC(C)(C)CC2=C1C(c1cccnc1)N(c1c(N2)cccc1)C(=O)c1ccccc1
STK038063
ZINC000018323807
ZINC000018323810

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Available files

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