3-chloro-5-(4-methoxyphenyl)-N-[2-(methylsulfanyl)phenyl]-7-(trifluoromethyl)-4,5,6,7-tetrahydropyrazolo[1,5-a]pyrimidine-2-carboxamide
Chemical Structure Depiction of
3-chloro-5-(4-methoxyphenyl)-N-[2-(methylsulfanyl)phenyl]-7-(trifluoromethyl)-4,5,6,7-tetrahydropyrazolo[1,5-a]pyrimidine-2-carboxamide
3-chloro-5-(4-methoxyphenyl)-N-[2-(methylsulfanyl)phenyl]-7-(trifluoromethyl)-4,5,6,7-tetrahydropyrazolo[1,5-a]pyrimidine-2-carboxamide
Compound characteristics
| Compound ID: | 3209-1144 |
| Compound Name: | 3-chloro-5-(4-methoxyphenyl)-N-[2-(methylsulfanyl)phenyl]-7-(trifluoromethyl)-4,5,6,7-tetrahydropyrazolo[1,5-a]pyrimidine-2-carboxamide |
| Molecular Weight: | 496.94 |
| Molecular Formula: | C22 H20 Cl F3 N4 O2 S |
| Smiles: | COc1ccc(cc1)C1CC(C(F)(F)F)n2c(c(c(C(Nc3ccccc3SC)=O)n2)[Cl])N1 |
| Stereo: | RACEMIC MIXTURE (RELATIVE) |
| logP: | 5.313 |
| logD: | 5.313 |
| logSw: | -5.9914 |
| Hydrogen bond acceptors count: | 5 |
| Hydrogen bond donors count: | 2 |
| Polar surface area: | 55.998 |
| InChI Key: | PPEIPNWONOEWKL-UHFFFAOYSA-N |