rel-(5R,7S)-N-(5-chloro-2-methoxyphenyl)-5-(4-methylphenyl)-7-(trifluoromethyl)-4,5,6,7-tetrahydropyrazolo[1,5-a]pyrimidine-3-carboxamide
Chemical Structure Depiction of
rel-(5R,7S)-N-(5-chloro-2-methoxyphenyl)-5-(4-methylphenyl)-7-(trifluoromethyl)-4,5,6,7-tetrahydropyrazolo[1,5-a]pyrimidine-3-carboxamide
rel-(5R,7S)-N-(5-chloro-2-methoxyphenyl)-5-(4-methylphenyl)-7-(trifluoromethyl)-4,5,6,7-tetrahydropyrazolo[1,5-a]pyrimidine-3-carboxamide
Compound characteristics
| Compound ID: | K610-0447 |
| Compound Name: | rel-(5R,7S)-N-(5-chloro-2-methoxyphenyl)-5-(4-methylphenyl)-7-(trifluoromethyl)-4,5,6,7-tetrahydropyrazolo[1,5-a]pyrimidine-3-carboxamide |
| Molecular Weight: | 464.87 |
| Molecular Formula: | C22 H20 Cl F3 N4 O2 |
| Smiles: | Cc1ccc(cc1)[C@H]1C[C@@H](C(F)(F)F)n2c(c(cn2)C(Nc2cc(ccc2OC)[Cl])=O)N1 |
| Stereo: | MIXTURE OF STEREOISOMERS |
| logP: | 5.2415 |
| logD: | 5.2228 |
| logSw: | -5.6319 |
| Hydrogen bond acceptors count: | 4 |
| Hydrogen bond donors count: | 2 |
| Polar surface area: | 55.538 |
| InChI Key: | YFSJQHIGPFQHPY-VQIMIIECSA-N |