rel-(3R,4R)-1-[4-cyano-3-(trifluoromethyl)phenyl]-4-[1-(2-methylpyridine-3-carbonyl)piperidin-4-yl]pyrrolidine-3-carboxamide
Chemical Structure Depiction of
rel-(3R,4R)-1-[4-cyano-3-(trifluoromethyl)phenyl]-4-[1-(2-methylpyridine-3-carbonyl)piperidin-4-yl]pyrrolidine-3-carboxamide
rel-(3R,4R)-1-[4-cyano-3-(trifluoromethyl)phenyl]-4-[1-(2-methylpyridine-3-carbonyl)piperidin-4-yl]pyrrolidine-3-carboxamide
Compound characteristics
Compound ID: | S954-5068 |
Compound Name: | rel-(3R,4R)-1-[4-cyano-3-(trifluoromethyl)phenyl]-4-[1-(2-methylpyridine-3-carbonyl)piperidin-4-yl]pyrrolidine-3-carboxamide |
Molecular Weight: | 485.51 |
Molecular Formula: | C25 H26 F3 N5 O2 |
Smiles: | Cc1c(cccn1)C(N1CCC(CC1)[C@@H]1CN(C[C@H]1C(N)=O)c1ccc(C#N)c(c1)C(F)(F)F)=O |
Stereo: | RELATIVE |
logP: | 2.1436 |
logD: | 2.1433 |
logSw: | -3.03 |
Hydrogen bond acceptors count: | 6 |
Hydrogen bond donors count: | 2 |
Polar surface area: | 81.04 |
InChI Key: | WOYWGIBADPDSJS-LEWJYISDSA-N |