N-(3-chloro-4-methylphenyl)-2-[6-(3,4-dimethylphenyl)-3-oxo[1,2,4]triazolo[4,3-b]pyridazin-2(3H)-yl]acetamide
Chemical Structure Depiction of
N-(3-chloro-4-methylphenyl)-2-[6-(3,4-dimethylphenyl)-3-oxo[1,2,4]triazolo[4,3-b]pyridazin-2(3H)-yl]acetamide
N-(3-chloro-4-methylphenyl)-2-[6-(3,4-dimethylphenyl)-3-oxo[1,2,4]triazolo[4,3-b]pyridazin-2(3H)-yl]acetamide
Compound characteristics
| Compound ID: | M452-0573 |
| Compound Name: | N-(3-chloro-4-methylphenyl)-2-[6-(3,4-dimethylphenyl)-3-oxo[1,2,4]triazolo[4,3-b]pyridazin-2(3H)-yl]acetamide |
| Molecular Weight: | 421.88 |
| Molecular Formula: | C22 H20 Cl N5 O2 |
| Smiles: | Cc1ccc(cc1C)C1C=CC2=NN(CC(Nc3ccc(C)c(c3)[Cl])=O)C(N2N=1)=O |
| Stereo: | ACHIRAL |
| logP: | 5.7738 |
| logD: | 5.7737 |
| logSw: | -6.0518 |
| Hydrogen bond acceptors count: | 6 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 67.906 |
| InChI Key: | XCVMHOJHRJEJSY-UHFFFAOYSA-N |