N-(4-acetamidophenyl)-2-{[6-(2H-1,3-benzodioxol-5-yl)[1,2,4]triazolo[4,3-b]pyridazin-3-yl]sulfanyl}acetamide
Chemical Structure Depiction of
N-(4-acetamidophenyl)-2-{[6-(2H-1,3-benzodioxol-5-yl)[1,2,4]triazolo[4,3-b]pyridazin-3-yl]sulfanyl}acetamide
N-(4-acetamidophenyl)-2-{[6-(2H-1,3-benzodioxol-5-yl)[1,2,4]triazolo[4,3-b]pyridazin-3-yl]sulfanyl}acetamide
Compound characteristics
| Compound ID: | G856-6502 |
| Compound Name: | N-(4-acetamidophenyl)-2-{[6-(2H-1,3-benzodioxol-5-yl)[1,2,4]triazolo[4,3-b]pyridazin-3-yl]sulfanyl}acetamide |
| Molecular Weight: | 462.49 |
| Molecular Formula: | C22 H18 N6 O4 S |
| Smiles: | CC(Nc1ccc(cc1)NC(CSc1nnc2ccc(c3ccc4c(c3)OCO4)nn12)=O)=O |
| Stereo: | ACHIRAL |
| logP: | 2.589 |
| logD: | 2.589 |
| logSw: | -3.0396 |
| Hydrogen bond acceptors count: | 10 |
| Hydrogen bond donors count: | 2 |
| Polar surface area: | 96.234 |
| InChI Key: | UUKRKUZGUCKMIB-UHFFFAOYSA-N |