Vitas-M small molecule compound
3-(4-methoxyphenyl)-11-(4-methylphenyl)-10-(trifluoroacetyl)-2,3,4,5,10,11-hexahydro-1H-dibenzo[b,e][1,4]diazepin-1-one
Catalog ID
STL444600
SMILES COc1ccc(cc1)C1CC(=O)C2=C(C1)Nc1ccccc1N(C2c1ccc(cc1)C)C(=O)C(F)(F)F
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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 C29H25F3N2O3 MW 506.52 g/mol Purity >90% as per NMR
InChI
InChI=1S/C29H25F3N2O3/c1-17-7-9-19(10-8-17)27-26-23(15-20(16-25(26)35)18-11-13-21(37-2)14-12-18)33-22-5-3-4-6-24(22)34(27)28(36)29(30,31)32/h3-14,20,27,33H,15-16H2,1-2H3InChIKey
FOCITIUZAJEGEH-UHFFFAOYSA-NSynonyms
675143-14-33(4METHOXYPHENYL)11(4METHYLPHENYL)10(222TRIFLUOROACETYL)234TRIHYDRO5H11HBENZO(B)BENZO(21F)14DIAZEPIN1ONE
3(4methoxyphenyl)11(4methylphenyl)10(trifluoroacetyl)23451011hexahydro1Hdibenzo(be)(14)diazepin1one
675143143
9(4methoxyphenyl)6(4methylphenyl)5(222trifluoroacetyl)891011tetrahydro6Hbenzo(b)(14)benzodiazepin7one
CC1=CC=C(C=C1)C2C3=C(CC(CC3=O)C4=CC=C(C=C4)OC)NC5=CC=CC=C5N2C(=O)C(F)(F)F
InChI=1SC29H25F3N2O3c1177919(10817)272623(1520(1625(26)35)18111321(372)141218)3322534624(22)34(27)28(36)29(3031)32h314202733H1516H212H3
MFCD03488658
ZINC000001409569
ZINC000001409572
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