2-[(3-{2-[(benzenesulfonyl)amino]ethyl}[1,2,4]triazolo[4,3-b]pyridazin-6-yl)sulfanyl]-N-(2-fluorophenyl)acetamide
Chemical Structure Depiction of
2-[(3-{2-[(benzenesulfonyl)amino]ethyl}[1,2,4]triazolo[4,3-b]pyridazin-6-yl)sulfanyl]-N-(2-fluorophenyl)acetamide
2-[(3-{2-[(benzenesulfonyl)amino]ethyl}[1,2,4]triazolo[4,3-b]pyridazin-6-yl)sulfanyl]-N-(2-fluorophenyl)acetamide
Compound characteristics
| Compound ID: | E551-0026 |
| Compound Name: | 2-[(3-{2-[(benzenesulfonyl)amino]ethyl}[1,2,4]triazolo[4,3-b]pyridazin-6-yl)sulfanyl]-N-(2-fluorophenyl)acetamide |
| Molecular Weight: | 486.55 |
| Molecular Formula: | C21 H19 F N6 O3 S2 |
| Smiles: | C(CNS(c1ccccc1)(=O)=O)c1nnc2ccc(nn12)SCC(Nc1ccccc1F)=O |
| Stereo: | ACHIRAL |
| logP: | 2.1897 |
| logD: | 2.1893 |
| logSw: | -2.8223 |
| Hydrogen bond acceptors count: | 11 |
| Hydrogen bond donors count: | 2 |
| Polar surface area: | 96.786 |
| InChI Key: | RBFVLLRVZBOVEP-UHFFFAOYSA-N |