rel-(3R,4R)-4-{1-[4-cyano-3-(trifluoromethyl)phenyl]piperidin-4-yl}-1-cyclopentyl-N-cyclopropylpyrrolidine-3-carboxamide
Chemical Structure Depiction of
rel-(3R,4R)-4-{1-[4-cyano-3-(trifluoromethyl)phenyl]piperidin-4-yl}-1-cyclopentyl-N-cyclopropylpyrrolidine-3-carboxamide
rel-(3R,4R)-4-{1-[4-cyano-3-(trifluoromethyl)phenyl]piperidin-4-yl}-1-cyclopentyl-N-cyclopropylpyrrolidine-3-carboxamide
Compound characteristics
| Compound ID: | S954-0306 |
| Compound Name: | rel-(3R,4R)-4-{1-[4-cyano-3-(trifluoromethyl)phenyl]piperidin-4-yl}-1-cyclopentyl-N-cyclopropylpyrrolidine-3-carboxamide |
| Molecular Weight: | 474.57 |
| Molecular Formula: | C26 H33 F3 N4 O |
| Smiles: | C1CCC(C1)N1C[C@@H](C2CCN(CC2)c2ccc(C#N)c(c2)C(F)(F)F)[C@@H](C1)C(NC1CC1)=O |
| Stereo: | RACEMIC MIXTURE (RELATIVE) |
| logP: | 4.004 |
| logD: | 1.6769 |
| logSw: | -4.1784 |
| Hydrogen bond acceptors count: | 4 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 48.83 |
| InChI Key: | IPZUBYOICCPQJB-PKTZIBPZSA-N |