4-methoxy-N-{[6-(4-methoxyphenyl)[1,2,4]triazolo[4,3-b]pyridazin-3-yl]methyl}-2-methylbenzamide
Chemical Structure Depiction of
4-methoxy-N-{[6-(4-methoxyphenyl)[1,2,4]triazolo[4,3-b]pyridazin-3-yl]methyl}-2-methylbenzamide
4-methoxy-N-{[6-(4-methoxyphenyl)[1,2,4]triazolo[4,3-b]pyridazin-3-yl]methyl}-2-methylbenzamide
Compound characteristics
| Compound ID: | S554-0727 |
| Compound Name: | 4-methoxy-N-{[6-(4-methoxyphenyl)[1,2,4]triazolo[4,3-b]pyridazin-3-yl]methyl}-2-methylbenzamide |
| Molecular Weight: | 403.44 |
| Molecular Formula: | C22 H21 N5 O3 |
| Smiles: | Cc1cc(ccc1C(NCc1nnc2ccc(c3ccc(cc3)OC)nn12)=O)OC |
| Stereo: | ACHIRAL |
| logP: | 3.3112 |
| logD: | 3.3112 |
| logSw: | -3.5631 |
| Hydrogen bond acceptors count: | 7 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 72.874 |
| InChI Key: | UREFXWKQFYNKSP-UHFFFAOYSA-N |