rel-(5R,7S)-5-(3-methoxyphenyl)-N-[(pyridin-3-yl)methyl]-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)methyl]-7-(trifluoromethyl)-4,5,6,7-tetrahydropyrazolo[1,5-a]pyrimidine-3-carboxamide
rel-(5R,7S)-5-(3-methoxyphenyl)-N-[(pyridin-3-yl)methyl]-7-(trifluoromethyl)-4,5,6,7-tetrahydropyrazolo[1,5-a]pyrimidine-3-carboxamide
Compound characteristics
| Compound ID: | 7213-0101 |
| Compound Name: | rel-(5R,7S)-5-(3-methoxyphenyl)-N-[(pyridin-3-yl)methyl]-7-(trifluoromethyl)-4,5,6,7-tetrahydropyrazolo[1,5-a]pyrimidine-3-carboxamide |
| Molecular Weight: | 431.42 |
| Molecular Formula: | C21 H20 F3 N5 O2 |
| Smiles: | COc1cccc(c1)[C@H]1C[C@@H](C(F)(F)F)n2c(c(cn2)C(NCc2cccnc2)=O)N1 |
| Stereo: | RELATIVE |
| logP: | 3.0357 |
| logD: | 3.0356 |
| logSw: | -3.1507 |
| Hydrogen bond acceptors count: | 5 |
| Hydrogen bond donors count: | 2 |
| Polar surface area: | 66.989 |
| InChI Key: | ZXUNBFXBUDOGMM-QZTJIDSGSA-N |