N-{[6-(4-methoxyphenyl)[1,2,4]triazolo[4,3-b]pyridazin-3-yl]methyl}-2-methylbenzamide
Chemical Structure Depiction of
N-{[6-(4-methoxyphenyl)[1,2,4]triazolo[4,3-b]pyridazin-3-yl]methyl}-2-methylbenzamide
N-{[6-(4-methoxyphenyl)[1,2,4]triazolo[4,3-b]pyridazin-3-yl]methyl}-2-methylbenzamide
Compound characteristics
| Compound ID: | S554-0738 |
| Compound Name: | N-{[6-(4-methoxyphenyl)[1,2,4]triazolo[4,3-b]pyridazin-3-yl]methyl}-2-methylbenzamide |
| Molecular Weight: | 373.41 |
| Molecular Formula: | C21 H19 N5 O2 |
| Smiles: | Cc1ccccc1C(NCc1nnc2ccc(c3ccc(cc3)OC)nn12)=O |
| Stereo: | ACHIRAL |
| logP: | 3.1303 |
| logD: | 3.1302 |
| logSw: | -3.3975 |
| Hydrogen bond acceptors count: | 6 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 65.33 |
| InChI Key: | AFIMAKNYIYUJCD-UHFFFAOYSA-N |