2-{[4-(azepan-1-yl)pyrimidin-2-yl]sulfanyl}-N-(5-chloro-2-methoxyphenyl)acetamide
Chemical Structure Depiction of
2-{[4-(azepan-1-yl)pyrimidin-2-yl]sulfanyl}-N-(5-chloro-2-methoxyphenyl)acetamide
2-{[4-(azepan-1-yl)pyrimidin-2-yl]sulfanyl}-N-(5-chloro-2-methoxyphenyl)acetamide
Compound characteristics
| Compound ID: | M459-2909 |
| Compound Name: | 2-{[4-(azepan-1-yl)pyrimidin-2-yl]sulfanyl}-N-(5-chloro-2-methoxyphenyl)acetamide |
| Molecular Weight: | 406.93 |
| Molecular Formula: | C19 H23 Cl N4 O2 S |
| Smiles: | COc1ccc(cc1NC(CSc1nccc(n1)N1CCCCCC1)=O)[Cl] |
| Stereo: | ACHIRAL |
| logP: | 4.568 |
| logD: | 4.5645 |
| logSw: | -4.6931 |
| Hydrogen bond acceptors count: | 6 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 51.021 |
| InChI Key: | RJUGAZMHMZWBDW-UHFFFAOYSA-N |