N-[2-(azepan-1-yl)ethyl]-2-{[3-(4-methylphenoxy)pyrazin-2-yl]sulfanyl}acetamide
Chemical Structure Depiction of
N-[2-(azepan-1-yl)ethyl]-2-{[3-(4-methylphenoxy)pyrazin-2-yl]sulfanyl}acetamide
N-[2-(azepan-1-yl)ethyl]-2-{[3-(4-methylphenoxy)pyrazin-2-yl]sulfanyl}acetamide
Compound characteristics
| Compound ID: | L899-0201 |
| Compound Name: | N-[2-(azepan-1-yl)ethyl]-2-{[3-(4-methylphenoxy)pyrazin-2-yl]sulfanyl}acetamide |
| Molecular Weight: | 400.54 |
| Molecular Formula: | C21 H28 N4 O2 S |
| Smiles: | Cc1ccc(cc1)Oc1c(nccn1)SCC(NCCN1CCCCCC1)=O |
| Stereo: | ACHIRAL |
| logP: | 3.5344 |
| logD: | 2.2412 |
| logSw: | -3.6667 |
| Hydrogen bond acceptors count: | 7 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 54.326 |
| InChI Key: | CGXXIIAISOEHMD-UHFFFAOYSA-N |