ethyl 4-(2-{[6-(benzylamino)pyridazin-3-yl]sulfanyl}acetamido)benzoate
Chemical Structure Depiction of
ethyl 4-(2-{[6-(benzylamino)pyridazin-3-yl]sulfanyl}acetamido)benzoate
ethyl 4-(2-{[6-(benzylamino)pyridazin-3-yl]sulfanyl}acetamido)benzoate
Compound characteristics
| Compound ID: | F814-0718 |
| Compound Name: | ethyl 4-(2-{[6-(benzylamino)pyridazin-3-yl]sulfanyl}acetamido)benzoate |
| Molecular Weight: | 422.5 |
| Molecular Formula: | C22 H22 N4 O3 S |
| Smiles: | CCOC(c1ccc(cc1)NC(CSc1ccc(NCc2ccccc2)nn1)=O)=O |
| Stereo: | ACHIRAL |
| logP: | 3.9626 |
| logD: | 3.9625 |
| logSw: | -3.9837 |
| Hydrogen bond acceptors count: | 8 |
| Hydrogen bond donors count: | 2 |
| Polar surface area: | 75.776 |
| InChI Key: | LNXSQQZMXJGCJN-UHFFFAOYSA-N |