N-[rel-(3R,4R)-4-(hydroxymethyl)-1-(3-methylbenzoyl)piperidin-3-yl]pyridine-3-carboxamide
Chemical Structure Depiction of
N-[rel-(3R,4R)-4-(hydroxymethyl)-1-(3-methylbenzoyl)piperidin-3-yl]pyridine-3-carboxamide
N-[rel-(3R,4R)-4-(hydroxymethyl)-1-(3-methylbenzoyl)piperidin-3-yl]pyridine-3-carboxamide
Compound characteristics
| Compound ID: | S617-0042 |
| Compound Name: | N-[rel-(3R,4R)-4-(hydroxymethyl)-1-(3-methylbenzoyl)piperidin-3-yl]pyridine-3-carboxamide |
| Molecular Weight: | 353.42 |
| Molecular Formula: | C20 H23 N3 O3 |
| Smiles: | Cc1cccc(c1)C(N1CC[C@H](CO)[C@@H](C1)NC(c1cccnc1)=O)=O |
| Stereo: | RACEMIC MIXTURE (RELATIVE) |
| logP: | 0.7799 |
| logD: | 0.7799 |
| logSw: | -1.1847 |
| Hydrogen bond acceptors count: | 6 |
| Hydrogen bond donors count: | 2 |
| Polar surface area: | 67.79 |
| InChI Key: | PAEDPSWHEALGRA-MSOLQXFVSA-N |