3-(6-{[(2H-1,3-benzodioxol-5-yl)methyl]amino}[1,2,4]triazolo[4,3-b]pyridazin-3-yl)-N-(4-ethoxyphenyl)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-(4-ethoxyphenyl)propanamide
3-(6-{[(2H-1,3-benzodioxol-5-yl)methyl]amino}[1,2,4]triazolo[4,3-b]pyridazin-3-yl)-N-(4-ethoxyphenyl)propanamide
Compound characteristics
| Compound ID: | G395-1468 |
| Compound Name: | 3-(6-{[(2H-1,3-benzodioxol-5-yl)methyl]amino}[1,2,4]triazolo[4,3-b]pyridazin-3-yl)-N-(4-ethoxyphenyl)propanamide |
| Molecular Weight: | 460.49 |
| Molecular Formula: | C24 H24 N6 O4 |
| Smiles: | CCOc1ccc(cc1)NC(CCc1nnc2ccc(NCc3ccc4c(c3)OCO4)nn12)=O |
| Stereo: | ACHIRAL |
| logP: | 2.7172 |
| logD: | 2.7171 |
| logSw: | -3.2063 |
| Hydrogen bond acceptors count: | 8 |
| Hydrogen bond donors count: | 2 |
| Polar surface area: | 91.563 |
| InChI Key: | GBYNYLPNIHSEQQ-UHFFFAOYSA-N |