N-[rel-(3R,4R)-1-[(4-cyanophenyl)methyl]-4-(hydroxymethyl)piperidin-3-yl]benzamide
Chemical Structure Depiction of
N-[rel-(3R,4R)-1-[(4-cyanophenyl)methyl]-4-(hydroxymethyl)piperidin-3-yl]benzamide
N-[rel-(3R,4R)-1-[(4-cyanophenyl)methyl]-4-(hydroxymethyl)piperidin-3-yl]benzamide
Compound characteristics
| Compound ID: | S229-1101 |
| Compound Name: | N-[rel-(3R,4R)-1-[(4-cyanophenyl)methyl]-4-(hydroxymethyl)piperidin-3-yl]benzamide |
| Molecular Weight: | 349.43 |
| Molecular Formula: | C21 H23 N3 O2 |
| Smiles: | C1CN(Cc2ccc(C#N)cc2)C[C@H]([C@H]1CO)NC(c1ccccc1)=O |
| Stereo: | RACEMIC MIXTURE (RELATIVE) |
| logP: | 1.7473 |
| logD: | 1.7116 |
| logSw: | -2.1491 |
| Hydrogen bond acceptors count: | 5 |
| Hydrogen bond donors count: | 2 |
| Polar surface area: | 62.412 |
| InChI Key: | RKXRQNQBIKSGMB-PMACEKPBSA-N |