ethyl 3-[2-({6-[4-(propylcarbamoyl)piperidin-1-yl]pyridazin-3-yl}sulfanyl)acetamido]benzoate
Chemical Structure Depiction of
ethyl 3-[2-({6-[4-(propylcarbamoyl)piperidin-1-yl]pyridazin-3-yl}sulfanyl)acetamido]benzoate
ethyl 3-[2-({6-[4-(propylcarbamoyl)piperidin-1-yl]pyridazin-3-yl}sulfanyl)acetamido]benzoate
Compound characteristics
| Compound ID: | L381-1337 |
| Compound Name: | ethyl 3-[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(Nc1cccc(c1)C(=O)OCC)=O)=O |
| Stereo: | ACHIRAL |
| logP: | 3.6227 |
| logD: | 3.6226 |
| logSw: | -3.6255 |
| Hydrogen bond acceptors count: | 10 |
| Hydrogen bond donors count: | 2 |
| Polar surface area: | 92.416 |
| InChI Key: | TYTMPWVOOJDRKD-UHFFFAOYSA-N |