rel-(5R,7S)-5-(3,4-dimethoxyphenyl)-N-[3-(1-hydroxyethyl)phenyl]-7-(trifluoromethyl)-4,5,6,7-tetrahydropyrazolo[1,5-a]pyrimidine-3-carboxamide
Chemical Structure Depiction of
rel-(5R,7S)-5-(3,4-dimethoxyphenyl)-N-[3-(1-hydroxyethyl)phenyl]-7-(trifluoromethyl)-4,5,6,7-tetrahydropyrazolo[1,5-a]pyrimidine-3-carboxamide
rel-(5R,7S)-5-(3,4-dimethoxyphenyl)-N-[3-(1-hydroxyethyl)phenyl]-7-(trifluoromethyl)-4,5,6,7-tetrahydropyrazolo[1,5-a]pyrimidine-3-carboxamide
Compound characteristics
| Compound ID: | 3209-0739 |
| Compound Name: | rel-(5R,7S)-5-(3,4-dimethoxyphenyl)-N-[3-(1-hydroxyethyl)phenyl]-7-(trifluoromethyl)-4,5,6,7-tetrahydropyrazolo[1,5-a]pyrimidine-3-carboxamide |
| Molecular Weight: | 490.48 |
| Molecular Formula: | C24 H25 F3 N4 O4 |
| Smiles: | CC(c1cccc(c1)NC(c1cnn2c1N[C@H](C[C@H]2C(F)(F)F)c1ccc(c(c1)OC)OC)=O)O |
| Stereo: | MIXTURE OF STEREOISOMERS |
| logP: | 3.4375 |
| logD: | 3.4375 |
| logSw: | -3.5784 |
| Hydrogen bond acceptors count: | 6 |
| Hydrogen bond donors count: | 3 |
| Polar surface area: | 79.877 |
| InChI Key: | GXYUYUIGJVFVCE-WGVFCVCTSA-N |