rel-(5R,7S)-5-(3-methoxyphenyl)-N-(pyridin-3-yl)-7-(trifluoromethyl)-4,5,6,7-tetrahydropyrazolo[1,5-a]pyrimidine-3-carboxamide
Chemical Structure Depiction of
rel-(5R,7S)-5-(3-methoxyphenyl)-N-(pyridin-3-yl)-7-(trifluoromethyl)-4,5,6,7-tetrahydropyrazolo[1,5-a]pyrimidine-3-carboxamide
rel-(5R,7S)-5-(3-methoxyphenyl)-N-(pyridin-3-yl)-7-(trifluoromethyl)-4,5,6,7-tetrahydropyrazolo[1,5-a]pyrimidine-3-carboxamide
Compound characteristics
Compound ID: | 7213-0123 |
Compound Name: | rel-(5R,7S)-5-(3-methoxyphenyl)-N-(pyridin-3-yl)-7-(trifluoromethyl)-4,5,6,7-tetrahydropyrazolo[1,5-a]pyrimidine-3-carboxamide |
Molecular Weight: | 417.39 |
Molecular Formula: | C20 H18 F3 N5 O2 |
Smiles: | COc1cccc(c1)[C@H]1C[C@@H](C(F)(F)F)n2c(c(cn2)C(Nc2cccnc2)=O)N1 |
Stereo: | RACEMIC MIXTURE (RELATIVE) |
logP: | 3.2233 |
logD: | 3.2232 |
logSw: | -3.3207 |
Hydrogen bond acceptors count: | 5 |
Hydrogen bond donors count: | 2 |
Polar surface area: | 65.667 |
InChI Key: | DSYAQDWOJUXISK-IAGOWNOFSA-N |