N-(3-acetylphenyl)-2-{[6-(pyridin-4-yl)[1,2,4]triazolo[4,3-b]pyridazin-3-yl]sulfanyl}acetamide
Chemical Structure Depiction of
N-(3-acetylphenyl)-2-{[6-(pyridin-4-yl)[1,2,4]triazolo[4,3-b]pyridazin-3-yl]sulfanyl}acetamide
N-(3-acetylphenyl)-2-{[6-(pyridin-4-yl)[1,2,4]triazolo[4,3-b]pyridazin-3-yl]sulfanyl}acetamide
Compound characteristics
| Compound ID: | G856-6644 |
| Compound Name: | N-(3-acetylphenyl)-2-{[6-(pyridin-4-yl)[1,2,4]triazolo[4,3-b]pyridazin-3-yl]sulfanyl}acetamide |
| Molecular Weight: | 404.45 |
| Molecular Formula: | C20 H16 N6 O2 S |
| Smiles: | CC(c1cccc(c1)NC(CSc1nnc2ccc(c3ccncc3)nn12)=O)=O |
| Stereo: | ACHIRAL |
| logP: | 2.0809 |
| logD: | 2.0798 |
| logSw: | -2.5474 |
| Hydrogen bond acceptors count: | 9 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 79.112 |
| InChI Key: | CAQJQZCIJMIKPP-UHFFFAOYSA-N |