rel-(5R,7S)-N,5-bis(4-bromophenyl)-7-(trifluoromethyl)-4,5,6,7-tetrahydropyrazolo[1,5-a]pyrimidine-3-carboxamide
Chemical Structure Depiction of
rel-(5R,7S)-N,5-bis(4-bromophenyl)-7-(trifluoromethyl)-4,5,6,7-tetrahydropyrazolo[1,5-a]pyrimidine-3-carboxamide
rel-(5R,7S)-N,5-bis(4-bromophenyl)-7-(trifluoromethyl)-4,5,6,7-tetrahydropyrazolo[1,5-a]pyrimidine-3-carboxamide
Compound characteristics
| Compound ID: | 3209-0977 |
| Compound Name: | rel-(5R,7S)-N,5-bis(4-bromophenyl)-7-(trifluoromethyl)-4,5,6,7-tetrahydropyrazolo[1,5-a]pyrimidine-3-carboxamide |
| Molecular Weight: | 544.17 |
| Molecular Formula: | C20 H15 Br2 F3 N4 O |
| Smiles: | C1[C@@H](C(F)(F)F)n2c(c(cn2)C(Nc2ccc(cc2)[Br])=O)N[C@H]1c1ccc(cc1)[Br] |
| Stereo: | RACEMIC MIXTURE (RELATIVE) |
| logP: | 6.0348 |
| logD: | 6.0342 |
| logSw: | -5.8034 |
| Hydrogen bond acceptors count: | 3 |
| Hydrogen bond donors count: | 2 |
| Polar surface area: | 48.605 |
| InChI Key: | FXQHOKCAUHVOSS-IAGOWNOFSA-N |