rel-(5R,7S)-N-(3,5-dimethylphenyl)-5-(furan-2-yl)-7-(trifluoromethyl)-4,5,6,7-tetrahydropyrazolo[1,5-a]pyrimidine-2-carboxamide
Chemical Structure Depiction of
rel-(5R,7S)-N-(3,5-dimethylphenyl)-5-(furan-2-yl)-7-(trifluoromethyl)-4,5,6,7-tetrahydropyrazolo[1,5-a]pyrimidine-2-carboxamide
rel-(5R,7S)-N-(3,5-dimethylphenyl)-5-(furan-2-yl)-7-(trifluoromethyl)-4,5,6,7-tetrahydropyrazolo[1,5-a]pyrimidine-2-carboxamide
Compound characteristics
Compound ID: | 6466-1031 |
Compound Name: | rel-(5R,7S)-N-(3,5-dimethylphenyl)-5-(furan-2-yl)-7-(trifluoromethyl)-4,5,6,7-tetrahydropyrazolo[1,5-a]pyrimidine-2-carboxamide |
Molecular Weight: | 404.39 |
Molecular Formula: | C20 H19 F3 N4 O2 |
Smiles: | Cc1cc(C)cc(c1)NC(c1cc2N[C@H](C[C@@H](C(F)(F)F)n2n1)c1ccco1)=O |
Stereo: | RACEMIC MIXTURE (RELATIVE) |
logP: | 4.3731 |
logD: | 4.3731 |
logSw: | -4.3185 |
Hydrogen bond acceptors count: | 4 |
Hydrogen bond donors count: | 2 |
Polar surface area: | 59.436 |
InChI Key: | MFTCHNAHOWVLKL-RHSMWYFYSA-N |