Vitas-M small molecule compound
1-(1,3,4,5-tetrahydro-2H-pyrido[4,3-b]indol-2-yl)-2-{4-[3-(trifluoromethyl)phenyl]piperazin-1-yl}propan-1-one
Catalog ID
STL333258
SMILES O=C(C(N1CCN(CC1)c1cccc(c1)C(F)(F)F)C)N1CCc2c(C1)c1ccccc1[nH]2
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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 C25H27F3N4O MW 456.51 g/mol Purity >90% as per NMR
InChI
InChI=1S/C25H27F3N4O/c1-17(24(33)32-10-9-23-21(16-32)20-7-2-3-8-22(20)29-23)30-11-13-31(14-12-30)19-6-4-5-18(15-19)25(26,27)28/h2-8,15,17,29H,9-14,16H2,1H3InChIKey
YBVADDWGTRKBMK-UHFFFAOYSA-NSynonyms
487035-26-71(1345tetrahydro2Hpyrido(43b)indol2yl)2(4(3(trifluoromethyl)phenyl)piperazin1yl)propan1one
1(1345tetrahydropyrido(43b)indol2yl)2(4(3(trifluoromethyl)phenyl)piperazin1yl)propan1one
1(34dihydro1Hpyrido(43b)indol2(5H)yl)2(4(3(trifluoromethyl)phenyl)piperazin1yl)propan1one
487035267
CC(C(=O)N1CCC2=C(C1)C3=CC=CC=C3N2)N4CCN(CC4)C5=CC=CC(=C5)C(F)(F)F
InChI=1SC25H27F3N4Oc117(24(33)321092321(1632)20723822(20)2923)30111331(141230)1964518(1519)25(2627)28h28151729H91416H21H3
MFCD03287191
O=C(C(N1CCN(CC1)c1cccc(c1)C(F)(F)F)C)N1CCc2c(C1)c1ccccc1(nH)2
ZINC000061878113
ZINC000061878114
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