rel-(5R,7S)-5-(4-methylphenyl)-N-[4-(trifluoromethoxy)phenyl]-7-(trifluoromethyl)-4,5,6,7-tetrahydropyrazolo[1,5-a]pyrimidine-3-carboxamide
Chemical Structure Depiction of
rel-(5R,7S)-5-(4-methylphenyl)-N-[4-(trifluoromethoxy)phenyl]-7-(trifluoromethyl)-4,5,6,7-tetrahydropyrazolo[1,5-a]pyrimidine-3-carboxamide
rel-(5R,7S)-5-(4-methylphenyl)-N-[4-(trifluoromethoxy)phenyl]-7-(trifluoromethyl)-4,5,6,7-tetrahydropyrazolo[1,5-a]pyrimidine-3-carboxamide
Compound characteristics
| Compound ID: | 3209-1307 |
| Compound Name: | rel-(5R,7S)-5-(4-methylphenyl)-N-[4-(trifluoromethoxy)phenyl]-7-(trifluoromethyl)-4,5,6,7-tetrahydropyrazolo[1,5-a]pyrimidine-3-carboxamide |
| Molecular Weight: | 484.4 |
| Molecular Formula: | C22 H18 F6 N4 O2 |
| Smiles: | Cc1ccc(cc1)[C@H]1C[C@@H](C(F)(F)F)n2c(c(cn2)C(Nc2ccc(cc2)OC(F)(F)F)=O)N1 |
| Stereo: | RACEMIC MIXTURE (RELATIVE) |
| logP: | 5.9816 |
| logD: | 5.9816 |
| logSw: | -5.4489 |
| Hydrogen bond acceptors count: | 4 |
| Hydrogen bond donors count: | 2 |
| Polar surface area: | 54.542 |
| InChI Key: | JKJNFOHBTCPXLK-QZTJIDSGSA-N |