Vitas-M small molecule compound
octahydro-2H-quinolizin-1-ylmethyl 5-(3,4-dimethoxyphenyl)-7-(trifluoromethyl)pyrazolo[1,5-a]pyrimidine-3-carboxylate
Catalog ID
STK679945
SMILES COc1cc(ccc1OC)c1cc(n2c(n1)c(cn2)C(=O)OCC1CCCN2C1CCCC2)C(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 C26H29F3N4O4 MW 518.54 g/mol Purity >90% as per NMR
InChI
InChI=1S/C26H29F3N4O4/c1-35-21-9-8-16(12-22(21)36-2)19-13-23(26(27,28)29)33-24(31-19)18(14-30-33)25(34)37-15-17-6-5-11-32-10-4-3-7-20(17)32/h8-9,12-14,17,20H,3-7,10-11,15H2,1-2H3InChIKey
XRJBVOWVZSJZLM-UHFFFAOYSA-NSynonyms
(6AZABICYCLO(440)DEC2YL)METHYL5(34DIMETHOXYPHENYL)7(TRIFLUOROMETHYL)8HYDROPYRAZOLO(15A)PYRIMIDINE3CARBOXYLATE
23467899aoctahydro1Hquinolizin1ylmethyl5(34dimethoxyphenyl)7(trifluoromethyl)pyrazolo(15a)pyrimidine3carboxylate
COC1=C(C=C(C=C1)C2=NC3=C(C=NN3C(=C2)C(F)(F)F)C(=O)OCC4CCCN5C4CCCC5)OC
InChI=1SC26H29F3N4O4c135219816(1222(21)362)191323(26(2728)29)3324(3119)18(143033)25(34)3715176511321043720(17)32h8912141720H37101115H212H3
MFCD03766512
octahydro2Hquinolizin1ylmethyl5(34dimethoxyphenyl)7(trifluoromethyl)pyrazolo(15a)pyrimidine3carboxylate
ZINC000000978070
ZINC000015276487
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