N-(4-ethoxyphenyl)-2-[(3-{2-[(4-methylbenzene-1-sulfonyl)amino]ethyl}[1,2,4]triazolo[4,3-b]pyridazin-6-yl)sulfanyl]acetamide
Chemical Structure Depiction of
N-(4-ethoxyphenyl)-2-[(3-{2-[(4-methylbenzene-1-sulfonyl)amino]ethyl}[1,2,4]triazolo[4,3-b]pyridazin-6-yl)sulfanyl]acetamide
N-(4-ethoxyphenyl)-2-[(3-{2-[(4-methylbenzene-1-sulfonyl)amino]ethyl}[1,2,4]triazolo[4,3-b]pyridazin-6-yl)sulfanyl]acetamide
Compound characteristics
| Compound ID: | E551-0159 |
| Compound Name: | N-(4-ethoxyphenyl)-2-[(3-{2-[(4-methylbenzene-1-sulfonyl)amino]ethyl}[1,2,4]triazolo[4,3-b]pyridazin-6-yl)sulfanyl]acetamide |
| Molecular Weight: | 526.64 |
| Molecular Formula: | C24 H26 N6 O4 S2 |
| Smiles: | CCOc1ccc(cc1)NC(CSc1ccc2nnc(CCNS(c3ccc(C)cc3)(=O)=O)n2n1)=O |
| Stereo: | ACHIRAL |
| logP: | 3.387 |
| logD: | 3.3865 |
| logSw: | -3.6932 |
| Hydrogen bond acceptors count: | 12 |
| Hydrogen bond donors count: | 2 |
| Polar surface area: | 104.607 |
| InChI Key: | NRJPTZBAHZXRFX-UHFFFAOYSA-N |