rel-(5R,7S)-3-chloro-N-cyclohexyl-5-(3,4-dimethoxyphenyl)-7-(trifluoromethyl)-4,5,6,7-tetrahydropyrazolo[1,5-a]pyrimidine-2-carboxamide
Chemical Structure Depiction of
rel-(5R,7S)-3-chloro-N-cyclohexyl-5-(3,4-dimethoxyphenyl)-7-(trifluoromethyl)-4,5,6,7-tetrahydropyrazolo[1,5-a]pyrimidine-2-carboxamide
rel-(5R,7S)-3-chloro-N-cyclohexyl-5-(3,4-dimethoxyphenyl)-7-(trifluoromethyl)-4,5,6,7-tetrahydropyrazolo[1,5-a]pyrimidine-2-carboxamide
Compound characteristics
| Compound ID: | 3209-1256 |
| Compound Name: | rel-(5R,7S)-3-chloro-N-cyclohexyl-5-(3,4-dimethoxyphenyl)-7-(trifluoromethyl)-4,5,6,7-tetrahydropyrazolo[1,5-a]pyrimidine-2-carboxamide |
| Molecular Weight: | 486.92 |
| Molecular Formula: | C22 H26 Cl F3 N4 O3 |
| Smiles: | COc1ccc(cc1OC)[C@@H]1C[C@H](C(F)(F)F)n2c(c(c(C(NC3CCCCC3)=O)n2)[Cl])N1 |
| Stereo: | RACEMIC MIXTURE (RELATIVE) |
| logP: | 4.5388 |
| logD: | 4.5388 |
| logSw: | -4.9529 |
| Hydrogen bond acceptors count: | 5 |
| Hydrogen bond donors count: | 2 |
| Polar surface area: | 65.46 |
| InChI Key: | JQSRVQZTVYRABP-WMLDXEAASA-N |