Vitas-M small molecule compound

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

Catalog ID
STK364233
SMILES O=C1CC(CC2=C1C(Nc1c(N2)cccc1)c1cccnc1)c1ccccc1Cl

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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 C24H20ClN3O MW 401.90 g/mol Purity >90% as per NMR
InChI
InChI=1S/C24H20ClN3O/c25-18-8-2-1-7-17(18)16-12-21-23(22(29)13-16)24(15-6-5-11-26-14-15)28-20-10-4-3-9-19(20)27-21/h1-11,14,16,24,27-28H,12-13H2
InChIKey
MTEGUVDMVATFAT-UHFFFAOYSA-N
Synonyms

3(2chlorophenyl)11(pyridin3yl)23451011hexahydro1Hdibenzo(be)(14)diazepin1one
9(2chlorophenyl)6pyridin3yl56891011hexahydrobenzo(b)(14)benzodiazepin7one
C1C(CC(=O)C2=C1NC3=CC=CC=C3NC2C4=CN=CC=C4)C5=CC=CC=C5Cl
InChI=1SC24H20ClN3Oc2518821717(18)16122123(22(29)1316)24(156511261415)28201043919(20)2721h1111416242728H1213H2
MFCD02188773
ZINC000004074972
ZINC000004074975

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Available files

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