Vitas-M small molecule compound
11-(2,5-difluorophenyl)-3-(3,4,5-trimethoxyphenyl)-2,3,4,5,10,11-hexahydro-1H-dibenzo[b,e][1,4]diazepin-1-one
Catalog ID
STK403426
SMILES COc1c(OC)cc(cc1OC)C1CC(=O)C2=C(C1)Nc1ccccc1NC2c1cc(F)ccc1F
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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 C28H26F2N2O4 MW 492.52 g/mol Purity >90% as per NMR
InChI
InChI=1S/C28H26F2N2O4/c1-34-24-12-16(13-25(35-2)28(24)36-3)15-10-22-26(23(33)11-15)27(18-14-17(29)8-9-19(18)30)32-21-7-5-4-6-20(21)31-22/h4-9,12-15,27,31-32H,10-11H2,1-3H3InChIKey
COGPFKUTHOWVOQ-UHFFFAOYSA-NSynonyms
11(25difluorophenyl)3(345trimethoxyphenyl)23451011hexahydro1Hdibenzo(be)(14)diazepin1one
6(25difluorophenyl)9(345trimethoxyphenyl)56891011hexahydrobenzo(b)(14)benzodiazepin7one
COC1=CC(=CC(=C1OC)OC)C2CC3=C(C(NC4=CC=CC=C4N3)C5=C(C=CC(=C5)F)F)C(=O)C2
InChI=1SC28H26F2N2O4c134241216(1325(352)28(24)363)15102226(23(33)1115)27(181417(29)8919(18)30)3221754620(21)3122h491215273132H1011H213H3
MFCD03489257
ZINC000001434782
ZINC000001434785
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