2-[(3-{2-[(4-methoxybenzene-1-sulfonyl)amino]ethyl}[1,2,4]triazolo[4,3-b]pyridazin-6-yl)sulfanyl]-N-(3-methylphenyl)acetamide
Chemical Structure Depiction of
2-[(3-{2-[(4-methoxybenzene-1-sulfonyl)amino]ethyl}[1,2,4]triazolo[4,3-b]pyridazin-6-yl)sulfanyl]-N-(3-methylphenyl)acetamide
2-[(3-{2-[(4-methoxybenzene-1-sulfonyl)amino]ethyl}[1,2,4]triazolo[4,3-b]pyridazin-6-yl)sulfanyl]-N-(3-methylphenyl)acetamide
Compound characteristics
| Compound ID: | E551-0255 |
| Compound Name: | 2-[(3-{2-[(4-methoxybenzene-1-sulfonyl)amino]ethyl}[1,2,4]triazolo[4,3-b]pyridazin-6-yl)sulfanyl]-N-(3-methylphenyl)acetamide |
| Molecular Weight: | 512.61 |
| Molecular Formula: | C23 H24 N6 O4 S2 |
| Smiles: | Cc1cccc(c1)NC(CSc1ccc2nnc(CCNS(c3ccc(cc3)OC)(=O)=O)n2n1)=O |
| Stereo: | ACHIRAL |
| logP: | 2.9369 |
| logD: | 2.9368 |
| logSw: | -3.5444 |
| Hydrogen bond acceptors count: | 12 |
| Hydrogen bond donors count: | 2 |
| Polar surface area: | 105.027 |
| InChI Key: | HULDTAVMYNBWJS-UHFFFAOYSA-N |