N-{rel-(3R,4S)-3-(hydroxymethyl)-1-[(3-methoxyphenyl)acetyl]piperidin-4-yl}pyridine-3-carboxamide
Chemical Structure Depiction of
N-{rel-(3R,4S)-3-(hydroxymethyl)-1-[(3-methoxyphenyl)acetyl]piperidin-4-yl}pyridine-3-carboxamide
N-{rel-(3R,4S)-3-(hydroxymethyl)-1-[(3-methoxyphenyl)acetyl]piperidin-4-yl}pyridine-3-carboxamide
Compound characteristics
| Compound ID: | S292-0599 |
| Compound Name: | N-{rel-(3R,4S)-3-(hydroxymethyl)-1-[(3-methoxyphenyl)acetyl]piperidin-4-yl}pyridine-3-carboxamide |
| Molecular Weight: | 383.45 |
| Molecular Formula: | C21 H25 N3 O4 |
| Smiles: | COc1cccc(CC(N2CC[C@H]([C@H](C2)CO)NC(c2cccnc2)=O)=O)c1 |
| Stereo: | RELATIVE |
| logP: | 0.8831 |
| logD: | 0.8831 |
| logSw: | -1.2006 |
| Hydrogen bond acceptors count: | 7 |
| Hydrogen bond donors count: | 2 |
| Polar surface area: | 74.806 |
| InChI Key: | JZRXEZXSVNWCOM-HKUYNNGSSA-N |