4-methyl-N-{[6-(4-methylphenyl)[1,2,4]triazolo[4,3-b]pyridazin-3-yl]methyl}benzamide
Chemical Structure Depiction of
4-methyl-N-{[6-(4-methylphenyl)[1,2,4]triazolo[4,3-b]pyridazin-3-yl]methyl}benzamide
4-methyl-N-{[6-(4-methylphenyl)[1,2,4]triazolo[4,3-b]pyridazin-3-yl]methyl}benzamide
Compound characteristics
| Compound ID: | S554-0588 |
| Compound Name: | 4-methyl-N-{[6-(4-methylphenyl)[1,2,4]triazolo[4,3-b]pyridazin-3-yl]methyl}benzamide |
| Molecular Weight: | 357.41 |
| Molecular Formula: | C21 H19 N5 O |
| Smiles: | Cc1ccc(cc1)C(NCc1nnc2ccc(c3ccc(C)cc3)nn12)=O |
| Stereo: | ACHIRAL |
| logP: | 3.4779 |
| logD: | 3.4779 |
| logSw: | -3.4631 |
| Hydrogen bond acceptors count: | 5 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 57.787 |
| InChI Key: | AMTLMFIXJHHRMZ-UHFFFAOYSA-N |