3-(6-{[(4-fluorophenyl)methyl]amino}[1,2,4]triazolo[4,3-b]pyridazin-3-yl)-1-(4-methylpiperidin-1-yl)propan-1-one
Chemical Structure Depiction of
3-(6-{[(4-fluorophenyl)methyl]amino}[1,2,4]triazolo[4,3-b]pyridazin-3-yl)-1-(4-methylpiperidin-1-yl)propan-1-one
3-(6-{[(4-fluorophenyl)methyl]amino}[1,2,4]triazolo[4,3-b]pyridazin-3-yl)-1-(4-methylpiperidin-1-yl)propan-1-one
Compound characteristics
| Compound ID: | G395-1266 |
| Compound Name: | 3-(6-{[(4-fluorophenyl)methyl]amino}[1,2,4]triazolo[4,3-b]pyridazin-3-yl)-1-(4-methylpiperidin-1-yl)propan-1-one |
| Molecular Weight: | 396.47 |
| Molecular Formula: | C21 H25 F N6 O |
| Smiles: | CC1CCN(CC1)C(CCc1nnc2ccc(NCc3ccc(cc3)F)nn12)=O |
| Stereo: | ACHIRAL |
| logP: | 2.0876 |
| logD: | 2.0876 |
| logSw: | -2.5325 |
| Hydrogen bond acceptors count: | 5 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 60.567 |
| InChI Key: | HWKSEVOTTVMEDC-UHFFFAOYSA-N |