rel-(5R,7S)-N-(3-chloro-2-methylphenyl)-7-(trifluoromethyl)-5-(3,4,5-trimethoxyphenyl)-4,5,6,7-tetrahydropyrazolo[1,5-a]pyrimidine-3-carboxamide
Chemical Structure Depiction of
rel-(5R,7S)-N-(3-chloro-2-methylphenyl)-7-(trifluoromethyl)-5-(3,4,5-trimethoxyphenyl)-4,5,6,7-tetrahydropyrazolo[1,5-a]pyrimidine-3-carboxamide
rel-(5R,7S)-N-(3-chloro-2-methylphenyl)-7-(trifluoromethyl)-5-(3,4,5-trimethoxyphenyl)-4,5,6,7-tetrahydropyrazolo[1,5-a]pyrimidine-3-carboxamide
Compound characteristics
Compound ID: | 3209-0903 |
Compound Name: | rel-(5R,7S)-N-(3-chloro-2-methylphenyl)-7-(trifluoromethyl)-5-(3,4,5-trimethoxyphenyl)-4,5,6,7-tetrahydropyrazolo[1,5-a]pyrimidine-3-carboxamide |
Molecular Weight: | 524.93 |
Molecular Formula: | C24 H24 Cl F3 N4 O4 |
Smiles: | Cc1c(cccc1[Cl])NC(c1cnn2c1N[C@H](C[C@H]2C(F)(F)F)c1cc(c(c(c1)OC)OC)OC)=O |
Stereo: | RACEMIC MIXTURE (RELATIVE) |
logP: | 5.0216 |
logD: | 5.0204 |
logSw: | -5.118 |
Hydrogen bond acceptors count: | 6 |
Hydrogen bond donors count: | 2 |
Polar surface area: | 70.885 |
InChI Key: | LDPSUIQKGGEKJM-YLJYHZDGSA-N |