rel-(5R,7S)-5-(4-bromophenyl)-N-(1-phenylethyl)-7-(trifluoromethyl)-4,5,6,7-tetrahydropyrazolo[1,5-a]pyrimidine-3-carboxamide
Chemical Structure Depiction of
rel-(5R,7S)-5-(4-bromophenyl)-N-(1-phenylethyl)-7-(trifluoromethyl)-4,5,6,7-tetrahydropyrazolo[1,5-a]pyrimidine-3-carboxamide
rel-(5R,7S)-5-(4-bromophenyl)-N-(1-phenylethyl)-7-(trifluoromethyl)-4,5,6,7-tetrahydropyrazolo[1,5-a]pyrimidine-3-carboxamide
Compound characteristics
| Compound ID: | Y508-7155 |
| Compound Name: | rel-(5R,7S)-5-(4-bromophenyl)-N-(1-phenylethyl)-7-(trifluoromethyl)-4,5,6,7-tetrahydropyrazolo[1,5-a]pyrimidine-3-carboxamide |
| Molecular Weight: | 493.33 |
| Molecular Formula: | C22 H20 Br F3 N4 O |
| Smiles: | CC(c1ccccc1)NC(c1cnn2c1N[C@@H](C[C@@H]2C(F)(F)F)c1ccc(cc1)[Br])=O |
| Stereo: | MIXTURE OF ISOMERS |
| logP: | 5.4346 |
| logD: | 5.4346 |
| logSw: | -5.3509 |
| Hydrogen bond acceptors count: | 3 |
| Hydrogen bond donors count: | 2 |
| Polar surface area: | 49.09 |
| InChI Key: | XEWLPHULGYTRGJ-WFELRXAXSA-N |