N-(4-acetylphenyl)-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-acetylphenyl)-2-[(3-{2-[(4-methylbenzene-1-sulfonyl)amino]ethyl}[1,2,4]triazolo[4,3-b]pyridazin-6-yl)sulfanyl]acetamide
N-(4-acetylphenyl)-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: | E551-0175 |
| Compound Name: | N-(4-acetylphenyl)-2-[(3-{2-[(4-methylbenzene-1-sulfonyl)amino]ethyl}[1,2,4]triazolo[4,3-b]pyridazin-6-yl)sulfanyl]acetamide |
| Molecular Weight: | 524.62 |
| Molecular Formula: | C24 H24 N6 O4 S2 |
| Smiles: | CC(c1ccc(cc1)NC(CSc1ccc2nnc(CCNS(c3ccc(C)cc3)(=O)=O)n2n1)=O)=O |
| Stereo: | ACHIRAL |
| logP: | 2.5601 |
| logD: | 2.5596 |
| logSw: | -2.9112 |
| Hydrogen bond acceptors count: | 13 |
| Hydrogen bond donors count: | 2 |
| Polar surface area: | 111.31 |
| InChI Key: | FYBRNRATTSZGES-UHFFFAOYSA-N |