2-{[2-(azepan-1-yl)-6-methylpyrimidin-4-yl]oxy}-N-{[4-(methylsulfanyl)phenyl]methyl}acetamide
Chemical Structure Depiction of
2-{[2-(azepan-1-yl)-6-methylpyrimidin-4-yl]oxy}-N-{[4-(methylsulfanyl)phenyl]methyl}acetamide
2-{[2-(azepan-1-yl)-6-methylpyrimidin-4-yl]oxy}-N-{[4-(methylsulfanyl)phenyl]methyl}acetamide
Compound characteristics
| Compound ID: | L868-1712 |
| Compound Name: | 2-{[2-(azepan-1-yl)-6-methylpyrimidin-4-yl]oxy}-N-{[4-(methylsulfanyl)phenyl]methyl}acetamide |
| Molecular Weight: | 400.54 |
| Molecular Formula: | C21 H28 N4 O2 S |
| Smiles: | Cc1cc(nc(n1)N1CCCCCC1)OCC(NCc1ccc(cc1)SC)=O |
| Stereo: | ACHIRAL |
| logP: | 4.5795 |
| logD: | 4.5783 |
| logSw: | -4.2727 |
| Hydrogen bond acceptors count: | 6 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 52.926 |
| InChI Key: | YWDORYWMUOWOJI-UHFFFAOYSA-N |