2-{[3-(4-benzylpiperidin-1-yl)pyrazin-2-yl]sulfanyl}-N-[(2,3-dimethoxyphenyl)methyl]acetamide
Chemical Structure Depiction of
2-{[3-(4-benzylpiperidin-1-yl)pyrazin-2-yl]sulfanyl}-N-[(2,3-dimethoxyphenyl)methyl]acetamide
2-{[3-(4-benzylpiperidin-1-yl)pyrazin-2-yl]sulfanyl}-N-[(2,3-dimethoxyphenyl)methyl]acetamide
Compound characteristics
| Compound ID: | L981-0937 |
| Compound Name: | 2-{[3-(4-benzylpiperidin-1-yl)pyrazin-2-yl]sulfanyl}-N-[(2,3-dimethoxyphenyl)methyl]acetamide |
| Molecular Weight: | 492.64 |
| Molecular Formula: | C27 H32 N4 O3 S |
| Smiles: | COc1cccc(CNC(CSc2c(nccn2)N2CCC(CC2)Cc2ccccc2)=O)c1OC |
| Stereo: | ACHIRAL |
| logP: | 5.1349 |
| logD: | 5.1349 |
| logSw: | -5.1678 |
| Hydrogen bond acceptors count: | 7 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 61.127 |
| InChI Key: | UAQNDIAXMFCLDJ-UHFFFAOYSA-N |