3-(6-{[(2H-1,3-benzodioxol-5-yl)methyl]amino}[1,2,4]triazolo[4,3-b]pyridazin-3-yl)-N-[(4-methylphenyl)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-[(4-methylphenyl)methyl]propanamide
3-(6-{[(2H-1,3-benzodioxol-5-yl)methyl]amino}[1,2,4]triazolo[4,3-b]pyridazin-3-yl)-N-[(4-methylphenyl)methyl]propanamide
Compound characteristics
| Compound ID: | G395-1500 |
| Compound Name: | 3-(6-{[(2H-1,3-benzodioxol-5-yl)methyl]amino}[1,2,4]triazolo[4,3-b]pyridazin-3-yl)-N-[(4-methylphenyl)methyl]propanamide |
| Molecular Weight: | 444.49 |
| Molecular Formula: | C24 H24 N6 O3 |
| Smiles: | Cc1ccc(CNC(CCc2nnc3ccc(NCc4ccc5c(c4)OCO5)nn23)=O)cc1 |
| Stereo: | ACHIRAL |
| logP: | 2.4718 |
| logD: | 2.4718 |
| logSw: | -2.8618 |
| Hydrogen bond acceptors count: | 7 |
| Hydrogen bond donors count: | 2 |
| Polar surface area: | 85.762 |
| InChI Key: | ZDZLOIURGMGQDN-UHFFFAOYSA-N |