5-chloro-N-{[6-(3,4-dimethylphenyl)[1,2,4]triazolo[4,3-b]pyridazin-3-yl]methyl}-2-methoxybenzamide
Chemical Structure Depiction of
5-chloro-N-{[6-(3,4-dimethylphenyl)[1,2,4]triazolo[4,3-b]pyridazin-3-yl]methyl}-2-methoxybenzamide
5-chloro-N-{[6-(3,4-dimethylphenyl)[1,2,4]triazolo[4,3-b]pyridazin-3-yl]methyl}-2-methoxybenzamide
Compound characteristics
| Compound ID: | S554-0870 |
| Compound Name: | 5-chloro-N-{[6-(3,4-dimethylphenyl)[1,2,4]triazolo[4,3-b]pyridazin-3-yl]methyl}-2-methoxybenzamide |
| Molecular Weight: | 421.88 |
| Molecular Formula: | C22 H20 Cl N5 O2 |
| Smiles: | Cc1ccc(cc1C)c1ccc2nnc(CNC(c3cc(ccc3OC)[Cl])=O)n2n1 |
| Stereo: | ACHIRAL |
| logP: | 4.4548 |
| logD: | 4.4523 |
| logSw: | -4.6232 |
| Hydrogen bond acceptors count: | 6 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 65.417 |
| InChI Key: | PMOYNWBGUPBJHU-UHFFFAOYSA-N |