N-(5-chloro-2,4-dimethoxyphenyl)-2-[6-(3,4-dimethylphenyl)-3-oxo[1,2,4]triazolo[4,3-b]pyridazin-2(3H)-yl]acetamide
Chemical Structure Depiction of
N-(5-chloro-2,4-dimethoxyphenyl)-2-[6-(3,4-dimethylphenyl)-3-oxo[1,2,4]triazolo[4,3-b]pyridazin-2(3H)-yl]acetamide
N-(5-chloro-2,4-dimethoxyphenyl)-2-[6-(3,4-dimethylphenyl)-3-oxo[1,2,4]triazolo[4,3-b]pyridazin-2(3H)-yl]acetamide
Compound characteristics
| Compound ID: | M452-0577 |
| Compound Name: | N-(5-chloro-2,4-dimethoxyphenyl)-2-[6-(3,4-dimethylphenyl)-3-oxo[1,2,4]triazolo[4,3-b]pyridazin-2(3H)-yl]acetamide |
| Molecular Weight: | 467.91 |
| Molecular Formula: | C23 H22 Cl N5 O4 |
| Smiles: | Cc1ccc(cc1C)C1C=CC2=NN(CC(Nc3cc(c(cc3OC)OC)[Cl])=O)C(N2N=1)=O |
| Stereo: | ACHIRAL |
| logP: | 4.6824 |
| logD: | 4.6797 |
| logSw: | -4.9275 |
| Hydrogen bond acceptors count: | 8 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 82.469 |
| InChI Key: | MRTHKJXSSVYFTG-UHFFFAOYSA-N |