N-(4-bromo-3-methylphenyl)-3-{[2-(pyridin-2-yl)ethyl]sulfanyl}propanamide
Chemical Structure Depiction of
N-(4-bromo-3-methylphenyl)-3-{[2-(pyridin-2-yl)ethyl]sulfanyl}propanamide
N-(4-bromo-3-methylphenyl)-3-{[2-(pyridin-2-yl)ethyl]sulfanyl}propanamide
Compound characteristics
| Compound ID: | C700-0388 |
| Compound Name: | N-(4-bromo-3-methylphenyl)-3-{[2-(pyridin-2-yl)ethyl]sulfanyl}propanamide |
| Molecular Weight: | 379.32 |
| Molecular Formula: | C17 H19 Br N2 O S |
| Smiles: | Cc1cc(ccc1[Br])NC(CCSCCc1ccccn1)=O |
| Stereo: | ACHIRAL |
| logP: | 3.9844 |
| logD: | 3.9841 |
| logSw: | -4.0654 |
| Hydrogen bond acceptors count: | 4 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 32.659 |
| InChI Key: | WAHUSFUQBJURAI-UHFFFAOYSA-N |