6-{[2-(piperidin-1-yl)ethyl]sulfanyl}-N-[(3,4,5-trimethoxyphenyl)methyl]pyridine-3-carboxamide
Chemical Structure Depiction of
6-{[2-(piperidin-1-yl)ethyl]sulfanyl}-N-[(3,4,5-trimethoxyphenyl)methyl]pyridine-3-carboxamide
6-{[2-(piperidin-1-yl)ethyl]sulfanyl}-N-[(3,4,5-trimethoxyphenyl)methyl]pyridine-3-carboxamide
Compound characteristics
| Compound ID: | L161-0172 |
| Compound Name: | 6-{[2-(piperidin-1-yl)ethyl]sulfanyl}-N-[(3,4,5-trimethoxyphenyl)methyl]pyridine-3-carboxamide |
| Molecular Weight: | 445.58 |
| Molecular Formula: | C23 H31 N3 O4 S |
| Smiles: | COc1cc(CNC(c2ccc(nc2)SCCN2CCCCC2)=O)cc(c1OC)OC |
| Stereo: | ACHIRAL |
| logP: | 2.9552 |
| logD: | 1.536 |
| logSw: | -3.2959 |
| Hydrogen bond acceptors count: | 8 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 59.839 |
| InChI Key: | BDQWXSXTCVVIAU-UHFFFAOYSA-N |