2-{[6-(azepan-1-yl)pyridazin-3-yl]sulfanyl}-N-(4-bromophenyl)acetamide
Chemical Structure Depiction of
2-{[6-(azepan-1-yl)pyridazin-3-yl]sulfanyl}-N-(4-bromophenyl)acetamide
2-{[6-(azepan-1-yl)pyridazin-3-yl]sulfanyl}-N-(4-bromophenyl)acetamide
Compound characteristics
| Compound ID: | F814-2408 |
| Compound Name: | 2-{[6-(azepan-1-yl)pyridazin-3-yl]sulfanyl}-N-(4-bromophenyl)acetamide |
| Molecular Weight: | 421.36 |
| Molecular Formula: | C18 H21 Br N4 O S |
| Smiles: | C1CCCN(CC1)c1ccc(nn1)SCC(Nc1ccc(cc1)[Br])=O |
| Stereo: | ACHIRAL |
| logP: | 4.7004 |
| logD: | 4.7001 |
| logSw: | -4.3744 |
| Hydrogen bond acceptors count: | 5 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 47.467 |
| InChI Key: | PXOSHNPZXGWVHB-UHFFFAOYSA-N |