N-{rel-(3R,4S)-3-(hydroxymethyl)-1-[3-(2-methoxyphenyl)propanoyl]piperidin-4-yl}pyridine-3-carboxamide
Chemical Structure Depiction of
N-{rel-(3R,4S)-3-(hydroxymethyl)-1-[3-(2-methoxyphenyl)propanoyl]piperidin-4-yl}pyridine-3-carboxamide
N-{rel-(3R,4S)-3-(hydroxymethyl)-1-[3-(2-methoxyphenyl)propanoyl]piperidin-4-yl}pyridine-3-carboxamide
Compound characteristics
| Compound ID: | S292-0686 |
| Compound Name: | N-{rel-(3R,4S)-3-(hydroxymethyl)-1-[3-(2-methoxyphenyl)propanoyl]piperidin-4-yl}pyridine-3-carboxamide |
| Molecular Weight: | 397.47 |
| Molecular Formula: | C22 H27 N3 O4 |
| Smiles: | COc1ccccc1CCC(N1CC[C@H]([C@H](C1)CO)NC(c1cccnc1)=O)=O |
| Stereo: | RACEMIC MIXTURE (RELATIVE) |
| logP: | 1.0789 |
| logD: | 1.0789 |
| logSw: | -1.0922 |
| Hydrogen bond acceptors count: | 7 |
| Hydrogen bond donors count: | 2 |
| Polar surface area: | 74.893 |
| InChI Key: | FCYWBNDPQDTSAV-OALUTQOASA-N |