3,4-dimethyl-N-[(6-phenyl[1,2,4]triazolo[4,3-b]pyridazin-3-yl)methyl]benzamide
Chemical Structure Depiction of
3,4-dimethyl-N-[(6-phenyl[1,2,4]triazolo[4,3-b]pyridazin-3-yl)methyl]benzamide
3,4-dimethyl-N-[(6-phenyl[1,2,4]triazolo[4,3-b]pyridazin-3-yl)methyl]benzamide
Compound characteristics
| Compound ID: | S554-0116 |
| Compound Name: | 3,4-dimethyl-N-[(6-phenyl[1,2,4]triazolo[4,3-b]pyridazin-3-yl)methyl]benzamide |
| Molecular Weight: | 357.41 |
| Molecular Formula: | C21 H19 N5 O |
| Smiles: | Cc1ccc(cc1C)C(NCc1nnc2ccc(c3ccccc3)nn12)=O |
| Stereo: | ACHIRAL |
| logP: | 3.512 |
| logD: | 3.5119 |
| logSw: | -3.6746 |
| Hydrogen bond acceptors count: | 5 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 57.787 |
| InChI Key: | KCCHLEARHLNJOL-UHFFFAOYSA-N |