rel-(5R,7S)-5-(3-methoxyphenyl)-N-(4-methoxyphenyl)-7-(trifluoromethyl)-4,5,6,7-tetrahydropyrazolo[1,5-a]pyrimidine-3-carboxamide
Chemical Structure Depiction of
rel-(5R,7S)-5-(3-methoxyphenyl)-N-(4-methoxyphenyl)-7-(trifluoromethyl)-4,5,6,7-tetrahydropyrazolo[1,5-a]pyrimidine-3-carboxamide
rel-(5R,7S)-5-(3-methoxyphenyl)-N-(4-methoxyphenyl)-7-(trifluoromethyl)-4,5,6,7-tetrahydropyrazolo[1,5-a]pyrimidine-3-carboxamide
Compound characteristics
Compound ID: | 6466-0173 |
Compound Name: | rel-(5R,7S)-5-(3-methoxyphenyl)-N-(4-methoxyphenyl)-7-(trifluoromethyl)-4,5,6,7-tetrahydropyrazolo[1,5-a]pyrimidine-3-carboxamide |
Molecular Weight: | 446.43 |
Molecular Formula: | C22 H21 F3 N4 O3 |
Smiles: | COc1ccc(cc1)NC(c1cnn2c1N[C@H](C[C@H]2C(F)(F)F)c1cccc(c1)OC)=O |
Stereo: | RACEMIC MIXTURE (RELATIVE) |
logP: | 4.2821 |
logD: | 4.2821 |
logSw: | -4.3265 |
Hydrogen bond acceptors count: | 5 |
Hydrogen bond donors count: | 2 |
Polar surface area: | 63.693 |
InChI Key: | TVEXXCALKWRGSH-RTBURBONSA-N |