Vitas-M small molecule compound
3-phenyl-11-[4-(trifluoromethyl)phenyl]-2,3,4,5,10,11-hexahydro-1H-dibenzo[b,e][1,4]diazepin-1-one
Catalog ID
STK055548
SMILES O=C1CC(CC2=C1C(Nc1c(N2)cccc1)c1ccc(cc1)C(F)(F)F)c1ccccc1
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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 C26H21F3N2O MW 434.46 g/mol Purity >90% as per NMR
InChI
InChI=1S/C26H21F3N2O/c27-26(28,29)19-12-10-17(11-13-19)25-24-22(30-20-8-4-5-9-21(20)31-25)14-18(15-23(24)32)16-6-2-1-3-7-16/h1-13,18,25,30-31H,14-15H2InChIKey
KMNOZBRXYDIKND-UHFFFAOYSA-NSynonyms
3phenyl11(4(trifluoromethyl)phenyl)23451011hexahydro1Hdibenzo(be)(14)diazepin1one
9phenyl6(4(trifluoromethyl)phenyl)56891011hexahydrobenzo(b)(14)benzodiazepin7one
C1C(CC(=O)C2=C1NC3=CC=CC=C3NC2C4=CC=C(C=C4)C(F)(F)F)C5=CC=CC=C5
InChI=1SC26H21F3N2Oc2726(2829)19121017(111319)252422(3020845921(20)3125)1418(1523(24)32)166213716h11318253031H1415H2
MFCD01874246
O=C1CC(CC2=C1C(Nc1c(N2)cccc1)c1ccc(cc1)C(F)(F)F)c1ccccc1
STK055548
ZINC000000709498
ZINC000000709501
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