Vitas-M small molecule compound
[7-(difluoromethyl)-5-(4-methylphenyl)pyrazolo[1,5-a]pyrimidin-3-yl][4-(tricyclo[3.3.1.1~3,7~]dec-2-yl)piperazin-1-yl]methanone
Catalog ID
STL399381
SMILES Cc1ccc(cc1)c1cc(C(F)F)n2c(n1)c(cn2)C(=O)N1CCN(CC1)C1C2CC3CC1CC(C2)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 C29H33F2N5O MW 505.61 g/mol Purity >90% as per NMR
InChI
InChI=1S/C29H33F2N5O/c1-17-2-4-20(5-3-17)24-15-25(27(30)31)36-28(33-24)23(16-32-36)29(37)35-8-6-34(7-9-35)26-21-11-18-10-19(13-21)14-22(26)12-18/h2-5,15-16,18-19,21-22,26-27H,6-14H2,1H3InChIKey
DZKZQCXTHORCFT-UHFFFAOYSA-NSynonyms
494217-76-4(4(2ADAMANTYL)PIPERAZIN1YL)(7(DIFLUOROMETHYL)5(4METHYLPHENYL)PYRAZOLO(15A)PYRIMIDIN3YL)METHANONE
(7(difluoromethyl)5(4methylphenyl)pyrazolo(15a)pyrimidin3yl)(4(tricyclo(3311~37~)dec2yl)piperazin1yl)methanone
3((4(2ADAMANTYL)1PIPERAZINYL)CARBONYL)7(DIFLUOROMETHYL)5(4METHYLPHENYL)PYRAZOLO(15A)PYRIMIDINE
494217764
CC1=CC=C(C=C1)C2=NC3=C(C=NN3C(=C2)C(F)F)C(=O)N4CCN(CC4)C5C6CC7CC(C6)CC5C7
InChI=1SC29H33F2N5Oc1172420(5317)241525(27(30)31)3628(3324)23(163236)29(37)358634(7935)262111181019(1321)1422(26)1218h251516181921222627H614H21H3
ZINC000008454578
ZINC8454578
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