2-[(3-{2-[(benzenesulfonyl)amino]ethyl}[1,2,4]triazolo[4,3-b]pyridazin-6-yl)sulfanyl]-N-cyclohexylacetamide
Chemical Structure Depiction of
2-[(3-{2-[(benzenesulfonyl)amino]ethyl}[1,2,4]triazolo[4,3-b]pyridazin-6-yl)sulfanyl]-N-cyclohexylacetamide
2-[(3-{2-[(benzenesulfonyl)amino]ethyl}[1,2,4]triazolo[4,3-b]pyridazin-6-yl)sulfanyl]-N-cyclohexylacetamide
Compound characteristics
| Compound ID: | E551-0060 |
| Compound Name: | 2-[(3-{2-[(benzenesulfonyl)amino]ethyl}[1,2,4]triazolo[4,3-b]pyridazin-6-yl)sulfanyl]-N-cyclohexylacetamide |
| Molecular Weight: | 474.6 |
| Molecular Formula: | C21 H26 N6 O3 S2 |
| Smiles: | C1CCC(CC1)NC(CSc1ccc2nnc(CCNS(c3ccccc3)(=O)=O)n2n1)=O |
| Stereo: | ACHIRAL |
| logP: | 2.3055 |
| logD: | 2.305 |
| logSw: | -2.6286 |
| Hydrogen bond acceptors count: | 11 |
| Hydrogen bond donors count: | 2 |
| Polar surface area: | 98.531 |
| InChI Key: | BKWOGTBSDJGDML-UHFFFAOYSA-N |