Vitas-M small molecule compound
[5-(1,3-benzodioxol-5-yl)-7-(trifluoromethyl)-4,5,6,7-tetrahydropyrazolo[1,5-a]pyrimidin-2-yl][4-(tricyclo[3.3.1.1~3,7~]dec-1-yl)piperazin-1-yl]methanone
Catalog ID
STK683775
SMILES O=C(c1nn2c(c1)NC(CC2C(F)(F)F)c1ccc2c(c1)OCO2)N1CCN(CC1)C12CC3CC(C2)CC(C1)C3
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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 C29H34F3N5O3 MW 557.62 g/mol Purity >90% as per NMR
InChI
InChI=1S/C29H34F3N5O3/c30-29(31,32)25-11-21(20-1-2-23-24(10-20)40-16-39-23)33-26-12-22(34-37(25)26)27(38)35-3-5-36(6-4-35)28-13-17-7-18(14-28)9-19(8-17)15-28/h1-2,10,12,17-19,21,25,33H,3-9,11,13-16H2InChIKey
NSYPWJCCSUXNEZ-UHFFFAOYSA-NSynonyms
(5(13benzodioxol5yl)7(trifluoromethyl)4567tetrahydropyrazolo(15a)pyrimidin2yl)(4(tricyclo(3311~37~)dec1yl)piperazin1yl)methanone
MFCD05258719
ZINC000098006298
ZINC000098006301
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