ethyl 4-[2-({6-[4-(propylcarbamoyl)piperidin-1-yl]pyridazin-3-yl}sulfanyl)acetamido]benzoate
Chemical Structure Depiction of
ethyl 4-[2-({6-[4-(propylcarbamoyl)piperidin-1-yl]pyridazin-3-yl}sulfanyl)acetamido]benzoate
ethyl 4-[2-({6-[4-(propylcarbamoyl)piperidin-1-yl]pyridazin-3-yl}sulfanyl)acetamido]benzoate
Compound characteristics
Compound ID: | L381-1223 |
Compound Name: | ethyl 4-[2-({6-[4-(propylcarbamoyl)piperidin-1-yl]pyridazin-3-yl}sulfanyl)acetamido]benzoate |
Molecular Weight: | 485.6 |
Molecular Formula: | C24 H31 N5 O4 S |
Smiles: | CCCNC(C1CCN(CC1)c1ccc(nn1)SCC(Nc1ccc(cc1)C(=O)OCC)=O)=O |
Stereo: | ACHIRAL |
logP: | 3.4421 |
logD: | 3.4419 |
logSw: | -3.4246 |
Hydrogen bond acceptors count: | 10 |
Hydrogen bond donors count: | 2 |
Polar surface area: | 92.416 |
InChI Key: | JZECXEJOOVBOBA-UHFFFAOYSA-N |