rel-(5R,7S)-N-{4-chloro-2-[hydroxy(phenyl)methyl]phenyl}-5-phenyl-7-(trifluoromethyl)-4,5,6,7-tetrahydropyrazolo[1,5-a]pyrimidine-3-carboxamide
Chemical Structure Depiction of
rel-(5R,7S)-N-{4-chloro-2-[hydroxy(phenyl)methyl]phenyl}-5-phenyl-7-(trifluoromethyl)-4,5,6,7-tetrahydropyrazolo[1,5-a]pyrimidine-3-carboxamide
rel-(5R,7S)-N-{4-chloro-2-[hydroxy(phenyl)methyl]phenyl}-5-phenyl-7-(trifluoromethyl)-4,5,6,7-tetrahydropyrazolo[1,5-a]pyrimidine-3-carboxamide
Compound characteristics
| Compound ID: | 3209-1445 |
| Compound Name: | rel-(5R,7S)-N-{4-chloro-2-[hydroxy(phenyl)methyl]phenyl}-5-phenyl-7-(trifluoromethyl)-4,5,6,7-tetrahydropyrazolo[1,5-a]pyrimidine-3-carboxamide |
| Molecular Weight: | 526.95 |
| Molecular Formula: | C27 H22 Cl F3 N4 O2 |
| Smiles: | C1[C@@H](C(F)(F)F)n2c(c(cn2)C(Nc2ccc(cc2C(c2ccccc2)O)[Cl])=O)N[C@H]1c1ccccc1 |
| Stereo: | MIXTURE OF STEREOISOMERS |
| logP: | 5.7035 |
| logD: | 5.7033 |
| logSw: | -5.7981 |
| Hydrogen bond acceptors count: | 4 |
| Hydrogen bond donors count: | 3 |
| Polar surface area: | 63.321 |
| InChI Key: | NLFKNOODZXKAEH-YOQGVNIDSA-N |