rel-(5R,7S)-5-(furan-2-yl)-N-[2-(1-hydroxyethyl)-4,5-dimethoxyphenyl]-7-(trifluoromethyl)-4,5,6,7-tetrahydropyrazolo[1,5-a]pyrimidine-2-carboxamide
Chemical Structure Depiction of
rel-(5R,7S)-5-(furan-2-yl)-N-[2-(1-hydroxyethyl)-4,5-dimethoxyphenyl]-7-(trifluoromethyl)-4,5,6,7-tetrahydropyrazolo[1,5-a]pyrimidine-2-carboxamide
rel-(5R,7S)-5-(furan-2-yl)-N-[2-(1-hydroxyethyl)-4,5-dimethoxyphenyl]-7-(trifluoromethyl)-4,5,6,7-tetrahydropyrazolo[1,5-a]pyrimidine-2-carboxamide
Compound characteristics
| Compound ID: | 6466-1011 |
| Compound Name: | rel-(5R,7S)-5-(furan-2-yl)-N-[2-(1-hydroxyethyl)-4,5-dimethoxyphenyl]-7-(trifluoromethyl)-4,5,6,7-tetrahydropyrazolo[1,5-a]pyrimidine-2-carboxamide |
| Molecular Weight: | 480.44 |
| Molecular Formula: | C22 H23 F3 N4 O5 |
| Smiles: | CC(c1cc(c(cc1NC(c1cc2N[C@H](C[C@@H](C(F)(F)F)n2n1)c1ccco1)=O)OC)OC)O |
| Stereo: | MIXTURE OF STEREOISOMERS |
| logP: | 2.6261 |
| logD: | 2.6261 |
| logSw: | -3.154 |
| Hydrogen bond acceptors count: | 7 |
| Hydrogen bond donors count: | 3 |
| Polar surface area: | 90.009 |
| InChI Key: | CZLMPEJSMDXNLE-RVMQYVRESA-N |