3-(6-{[(2H-1,3-benzodioxol-5-yl)methyl]amino}[1,2,4]triazolo[4,3-b]pyridazin-3-yl)-N-[(oxolan-2-yl)methyl]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-[(oxolan-2-yl)methyl]propanamide
3-(6-{[(2H-1,3-benzodioxol-5-yl)methyl]amino}[1,2,4]triazolo[4,3-b]pyridazin-3-yl)-N-[(oxolan-2-yl)methyl]propanamide
Compound characteristics
| Compound ID: | G395-1498 |
| Compound Name: | 3-(6-{[(2H-1,3-benzodioxol-5-yl)methyl]amino}[1,2,4]triazolo[4,3-b]pyridazin-3-yl)-N-[(oxolan-2-yl)methyl]propanamide |
| Molecular Weight: | 424.46 |
| Molecular Formula: | C21 H24 N6 O4 |
| Smiles: | C1CC(CNC(CCc2nnc3ccc(NCc4ccc5c(c4)OCO5)nn23)=O)OC1 |
| Stereo: | RACEMIC MIXTURE |
| logP: | 0.5039 |
| logD: | 0.5039 |
| logSw: | -1.9335 |
| Hydrogen bond acceptors count: | 8 |
| Hydrogen bond donors count: | 2 |
| Polar surface area: | 94.416 |
| InChI Key: | UPDPDHQJWOHQMI-OAHLLOKOSA-N |