N-[(6-phenyl[1,2,4]triazolo[4,3-b]pyridazin-3-yl)methyl]-1H-pyrrole-2-carboxamide
Chemical Structure Depiction of
N-[(6-phenyl[1,2,4]triazolo[4,3-b]pyridazin-3-yl)methyl]-1H-pyrrole-2-carboxamide
N-[(6-phenyl[1,2,4]triazolo[4,3-b]pyridazin-3-yl)methyl]-1H-pyrrole-2-carboxamide
Compound characteristics
| Compound ID: | S554-0072 |
| Compound Name: | N-[(6-phenyl[1,2,4]triazolo[4,3-b]pyridazin-3-yl)methyl]-1H-pyrrole-2-carboxamide |
| Molecular Weight: | 318.34 |
| Molecular Formula: | C17 H14 N6 O |
| Smiles: | C(c1nnc2ccc(c3ccccc3)nn12)NC(c1ccc[nH]1)=O |
| Stereo: | ACHIRAL |
| logP: | 1.8002 |
| logD: | 1.8002 |
| logSw: | -2.0875 |
| Hydrogen bond acceptors count: | 5 |
| Hydrogen bond donors count: | 2 |
| Polar surface area: | 67.853 |
| InChI Key: | FKRCLSSDFLKCFX-UHFFFAOYSA-N |