rel-(5R,7S)-N-(3,4-dichlorophenyl)-5-(furan-2-yl)-7-(trifluoromethyl)-4,5,6,7-tetrahydropyrazolo[1,5-a]pyrimidine-3-carboxamide
Chemical Structure Depiction of
rel-(5R,7S)-N-(3,4-dichlorophenyl)-5-(furan-2-yl)-7-(trifluoromethyl)-4,5,6,7-tetrahydropyrazolo[1,5-a]pyrimidine-3-carboxamide
rel-(5R,7S)-N-(3,4-dichlorophenyl)-5-(furan-2-yl)-7-(trifluoromethyl)-4,5,6,7-tetrahydropyrazolo[1,5-a]pyrimidine-3-carboxamide
Compound characteristics
| Compound ID: | K610-0524 |
| Compound Name: | rel-(5R,7S)-N-(3,4-dichlorophenyl)-5-(furan-2-yl)-7-(trifluoromethyl)-4,5,6,7-tetrahydropyrazolo[1,5-a]pyrimidine-3-carboxamide |
| Molecular Weight: | 445.23 |
| Molecular Formula: | C18 H13 Cl2 F3 N4 O2 |
| Smiles: | C1[C@@H](C(F)(F)F)n2c(c(cn2)C(Nc2ccc(c(c2)[Cl])[Cl])=O)N[C@H]1c1ccco1 |
| Stereo: | RACEMIC MIXTURE (RELATIVE) |
| logP: | 4.9614 |
| logD: | 4.9207 |
| logSw: | -5.1545 |
| Hydrogen bond acceptors count: | 4 |
| Hydrogen bond donors count: | 2 |
| Polar surface area: | 57.184 |
| InChI Key: | QXMAFEYIHKQMRE-UKRRQHHQSA-N |