Vitas-M small molecule compound

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

Catalog ID
STK363853
SMILES COc1ccc(cc1OC)C1CC(=O)C2=C(C1)Nc1ccccc1NC2c1ccncc1

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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 C26H25N3O3 MW 427.50 g/mol Purity >90% as per NMR
InChI
InChI=1S/C26H25N3O3/c1-31-23-8-7-17(15-24(23)32-2)18-13-21-25(22(30)14-18)26(16-9-11-27-12-10-16)29-20-6-4-3-5-19(20)28-21/h3-12,15,18,26,28-29H,13-14H2,1-2H3
InChIKey
YSPATPBMNCXEOI-UHFFFAOYSA-N
Synonyms

3(34dimethoxyphenyl)11(pyridin4yl)23451011hexahydro1Hdibenzo(be)(14)diazepin1one
9(34dimethoxyphenyl)6pyridin4yl56891011hexahydrobenzo(b)(14)benzodiazepin7one
COC1=C(C=C(C=C1)C2CC3=C(C(NC4=CC=CC=C4N3)C5=CC=NC=C5)C(=O)C2)OC
InChI=1SC26H25N3O3c131238717(1524(23)322)18132125(22(30)1418)26(1691127121016)2920643519(20)2821h3121518262829H1314H212H3
MFCD01874802
ZINC000000709636
ZINC000000709639

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Available files

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