Vitas-M small molecule compound

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

Catalog ID
STK207514
SMILES Fc1ccc(cc1)C1C2=C(CC(CC2=O)c2ccc(cc2)Cl)Nc2c(N1C(=O)C(F)(F)F)cccc2

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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 C27H19ClF4N2O2 MW 514.91 g/mol Purity >90% as per NMR
InChI
InChI=1S/C27H19ClF4N2O2/c28-18-9-5-15(6-10-18)17-13-21-24(23(35)14-17)25(16-7-11-19(29)12-8-16)34(26(36)27(30,31)32)22-4-2-1-3-20(22)33-21/h1-12,17,25,33H,13-14H2
InChIKey
TXDKRWZQCFVRSL-UHFFFAOYSA-N
Synonyms

3(4chlorophenyl)11(4fluorophenyl)10(222trifluoroacetyl)23451011hexahydro1Hdibenzo(be)(14)diazepin1one
3(4CHLOROPHENYL)11(4FLUOROPHENYL)10(222TRIFLUOROACETYL)234TRIHYDRO5H11HBENZO(B)BENZO(21F)14DIAZEPIN1ONE
3(4chlorophenyl)11(4fluorophenyl)10(trifluoroacetyl)23451011hexahydro1Hdibenzo(be)(14)diazepin1one
9(4chlorophenyl)6(4fluorophenyl)5(222trifluoroacetyl)891011tetrahydro6Hbenzo(b)(14)benzodiazepin7one
C1C(CC(=O)C2=C1NC3=CC=CC=C3N(C2C4=CC=C(C=C4)F)C(=O)C(F)(F)F)C5=CC=C(C=C5)Cl
InChI=1SC27H19ClF4N2O2c28189515(61018)17132124(23(35)1417)25(1671119(29)12816)34(26(36)27(3031)32)22421320(22)3321h112172533H1314H2
MFCD02375494
ZINC000009057826
ZINC000009057829

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Available files

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