Vitas-M small molecule compound
[5-(1,3-benzodioxol-5-yl)-7-(trifluoromethyl)pyrazolo[1,5-a]pyrimidin-2-yl][4-(tricyclo[3.3.1.1~3,7~]dec-1-yl)piperazin-1-yl]methanone
Catalog ID
STK680006
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 C29H30F3N5O3 MW 553.58 g/mol Purity >90% as per NMR
InChI
InChI=1S/C29H30F3N5O3/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/h1-2,10-12,17-19H,3-9,13-16H2InChIKey
PEJYZEIQQHOZSR-UHFFFAOYSA-NSynonyms
(4(1ADAMANTYL)PIPERAZIN1YL)(5(13BENZODIOXOL5YL)7(TRIFLUOROMETHYL)PYRAZOLO(15A)PYRIMIDIN2YL)METHANONE(5(13benzodioxol5yl)7(trifluoromethyl)pyrazolo(15a)pyrimidin2yl)(4(tricyclo(3311~37~)dec1yl)piperazin1yl)methanone
C1CN(CCN1C(=O)C2=NN3C(=CC(=NC3=C2)C4=CC5=C(C=C4)OCO5)C(F)(F)F)C67CC8CC(C6)CC(C8)C7
Registry IDs
MFCD03766613ZINC000033354949
ZINC33354949
Check stock
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Check stock on Vitas-MAvailable files
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