3-(6-{[(2H-1,3-benzodioxol-5-yl)methyl]amino}[1,2,4]triazolo[4,3-b]pyridazin-3-yl)-N-(butan-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-(butan-2-yl)propanamide
3-(6-{[(2H-1,3-benzodioxol-5-yl)methyl]amino}[1,2,4]triazolo[4,3-b]pyridazin-3-yl)-N-(butan-2-yl)propanamide
Compound characteristics
| Compound ID: | G395-1515 |
| Compound Name: | 3-(6-{[(2H-1,3-benzodioxol-5-yl)methyl]amino}[1,2,4]triazolo[4,3-b]pyridazin-3-yl)-N-(butan-2-yl)propanamide |
| Molecular Weight: | 396.45 |
| Molecular Formula: | C20 H24 N6 O3 |
| Smiles: | CCC(C)NC(CCc1nnc2ccc(NCc3ccc4c(c3)OCO4)nn12)=O |
| Stereo: | RACEMIC MIXTURE |
| logP: | 1.644 |
| logD: | 1.644 |
| logSw: | -2.2501 |
| Hydrogen bond acceptors count: | 7 |
| Hydrogen bond donors count: | 2 |
| Polar surface area: | 85.475 |
| InChI Key: | KTBMGCDDQVOFRM-ZDUSSCGKSA-N |