3-(6-{[(2H-1,3-benzodioxol-5-yl)methyl]amino}[1,2,4]triazolo[4,3-b]pyridazin-3-yl)-N-(5-methylpyridin-2-yl)propanamide
Chemical Structure Depiction of
3-(6-{[(2H-1,3-benzodioxol-5-yl)methyl]amino}[1,2,4]triazolo[4,3-b]pyridazin-3-yl)-N-(5-methylpyridin-2-yl)propanamide
3-(6-{[(2H-1,3-benzodioxol-5-yl)methyl]amino}[1,2,4]triazolo[4,3-b]pyridazin-3-yl)-N-(5-methylpyridin-2-yl)propanamide
Compound characteristics
| Compound ID: | G395-1503 |
| Compound Name: | 3-(6-{[(2H-1,3-benzodioxol-5-yl)methyl]amino}[1,2,4]triazolo[4,3-b]pyridazin-3-yl)-N-(5-methylpyridin-2-yl)propanamide |
| Molecular Weight: | 431.45 |
| Molecular Formula: | C22 H21 N7 O3 |
| Smiles: | Cc1ccc(NC(CCc2nnc3ccc(NCc4ccc5c(c4)OCO5)nn23)=O)nc1 |
| Stereo: | ACHIRAL |
| logP: | 2.3002 |
| logD: | 2.2997 |
| logSw: | -2.8398 |
| Hydrogen bond acceptors count: | 8 |
| Hydrogen bond donors count: | 2 |
| Polar surface area: | 94.144 |
| InChI Key: | NSQAIWVRUUTUSJ-UHFFFAOYSA-N |