N-[(2H-1,3-benzodioxol-5-yl)methyl]-2-{[3-(4-benzylpiperidin-1-yl)pyrazin-2-yl]sulfanyl}acetamide
Chemical Structure Depiction of
N-[(2H-1,3-benzodioxol-5-yl)methyl]-2-{[3-(4-benzylpiperidin-1-yl)pyrazin-2-yl]sulfanyl}acetamide
N-[(2H-1,3-benzodioxol-5-yl)methyl]-2-{[3-(4-benzylpiperidin-1-yl)pyrazin-2-yl]sulfanyl}acetamide
Compound characteristics
| Compound ID: | L981-0938 |
| Compound Name: | N-[(2H-1,3-benzodioxol-5-yl)methyl]-2-{[3-(4-benzylpiperidin-1-yl)pyrazin-2-yl]sulfanyl}acetamide |
| Molecular Weight: | 476.6 |
| Molecular Formula: | C26 H28 N4 O3 S |
| Smiles: | C1CN(CCC1Cc1ccccc1)c1c(nccn1)SCC(NCc1ccc2c(c1)OCO2)=O |
| Stereo: | ACHIRAL |
| logP: | 4.907 |
| logD: | 4.907 |
| logSw: | -4.9579 |
| Hydrogen bond acceptors count: | 7 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 62.895 |
| InChI Key: | LGMVVXSQAMITMU-UHFFFAOYSA-N |