Vitas-M small molecule compound
6-(3,4-dihydroisoquinolin-2(1H)-ylmethyl)-3-hydroxy-2-{[4-(2,2,2-trifluoroethyl)piperazin-1-yl]methyl}-4H-pyran-4-one
Catalog ID
STL494134
SMILES O=c1cc(CN2CCc3c(C2)cccc3)oc(c1O)CN1CCN(CC1)CC(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 C22H26F3N3O3 MW 437.46 g/mol Purity >90% as per NMR
InChI
InChI=1S/C22H26F3N3O3/c23-22(24,25)15-27-9-7-26(8-10-27)14-20-21(30)19(29)11-18(31-20)13-28-6-5-16-3-1-2-4-17(16)12-28/h1-4,11,30H,5-10,12-15H2InChIKey
JOAWUWCCNKIKNX-UHFFFAOYSA-NSynonyms
6((34dihydroisoquinolin2(1H)yl)methyl)3hydroxy2((4(222trifluoroethyl)piperazin1yl)methyl)4Hpyran4one
6(34dihydro1Hisoquinolin2ylmethyl)3hydroxy2((4(222trifluoroethyl)piperazin1yl)methyl)pyran4one
6(34dihydroisoquinolin2(1H)ylmethyl)3hydroxy2((4(222trifluoroethyl)piperazin1yl)methyl)4Hpyran4one
C1CN(CC2=CC=CC=C21)CC3=CC(=O)C(=C(O3)CN4CCN(CC4)CC(F)(F)F)O
InChI=1SC22H26F3N3O3c2322(2425)15279726(81027)142021(30)19(29)1118(3120)13286516312417(16)1228h141130H5101215H2
MFCD29057209
ZINC000253407117
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