2-{[6-(azepan-1-yl)pyridazin-3-yl]sulfanyl}-N-(3-chloro-4-fluorophenyl)acetamide
Chemical Structure Depiction of
2-{[6-(azepan-1-yl)pyridazin-3-yl]sulfanyl}-N-(3-chloro-4-fluorophenyl)acetamide
2-{[6-(azepan-1-yl)pyridazin-3-yl]sulfanyl}-N-(3-chloro-4-fluorophenyl)acetamide
Compound characteristics
Compound ID: | F814-2411 |
Compound Name: | 2-{[6-(azepan-1-yl)pyridazin-3-yl]sulfanyl}-N-(3-chloro-4-fluorophenyl)acetamide |
Molecular Weight: | 394.9 |
Molecular Formula: | C18 H20 Cl F N4 O S |
Smiles: | C1CCCN(CC1)c1ccc(nn1)SCC(Nc1ccc(c(c1)[Cl])F)=O |
Stereo: | ACHIRAL |
logP: | 4.5967 |
logD: | 4.5867 |
logSw: | -4.6463 |
Hydrogen bond acceptors count: | 5 |
Hydrogen bond donors count: | 1 |
Polar surface area: | 47.467 |
InChI Key: | PFZQOZXUCIGLGO-UHFFFAOYSA-N |