ethyl N-[3-(6-{[(4-fluorophenyl)methyl]amino}[1,2,4]triazolo[4,3-b]pyridazin-3-yl)propanoyl]alaninate
Chemical Structure Depiction of
ethyl N-[3-(6-{[(4-fluorophenyl)methyl]amino}[1,2,4]triazolo[4,3-b]pyridazin-3-yl)propanoyl]alaninate
ethyl N-[3-(6-{[(4-fluorophenyl)methyl]amino}[1,2,4]triazolo[4,3-b]pyridazin-3-yl)propanoyl]alaninate
Compound characteristics
| Compound ID: | G395-1325 |
| Compound Name: | ethyl N-[3-(6-{[(4-fluorophenyl)methyl]amino}[1,2,4]triazolo[4,3-b]pyridazin-3-yl)propanoyl]alaninate |
| Molecular Weight: | 414.44 |
| Molecular Formula: | C20 H23 F N6 O3 |
| Smiles: | CCOC(C(C)NC(CCc1nnc2ccc(NCc3ccc(cc3)F)nn12)=O)=O |
| Stereo: | RACEMIC MIXTURE |
| logP: | 1.3562 |
| logD: | 1.3562 |
| logSw: | -2.1559 |
| Hydrogen bond acceptors count: | 8 |
| Hydrogen bond donors count: | 2 |
| Polar surface area: | 88.835 |
| InChI Key: | FOMBHUIMCIQVBI-ZDUSSCGKSA-N |