3-acetamido-N-{[6-(4-methylphenyl)[1,2,4]triazolo[4,3-b]pyridazin-3-yl]methyl}benzamide
Chemical Structure Depiction of
3-acetamido-N-{[6-(4-methylphenyl)[1,2,4]triazolo[4,3-b]pyridazin-3-yl]methyl}benzamide
3-acetamido-N-{[6-(4-methylphenyl)[1,2,4]triazolo[4,3-b]pyridazin-3-yl]methyl}benzamide
Compound characteristics
| Compound ID: | S554-0513 |
| Compound Name: | 3-acetamido-N-{[6-(4-methylphenyl)[1,2,4]triazolo[4,3-b]pyridazin-3-yl]methyl}benzamide |
| Molecular Weight: | 400.44 |
| Molecular Formula: | C22 H20 N6 O2 |
| Smiles: | CC(Nc1cccc(c1)C(NCc1nnc2ccc(c3ccc(C)cc3)nn12)=O)=O |
| Stereo: | ACHIRAL |
| logP: | 2.5566 |
| logD: | 2.5566 |
| logSw: | -2.8757 |
| Hydrogen bond acceptors count: | 7 |
| Hydrogen bond donors count: | 2 |
| Polar surface area: | 81.049 |
| InChI Key: | GOOFVXCZTDYKCD-UHFFFAOYSA-N |