6-(3,4-dimethylphenyl)-2-{2-[4-(2-methoxyphenyl)piperazin-1-yl]-2-oxoethyl}[1,2,4]triazolo[4,3-b]pyridazin-3(2H)-one
Chemical Structure Depiction of
6-(3,4-dimethylphenyl)-2-{2-[4-(2-methoxyphenyl)piperazin-1-yl]-2-oxoethyl}[1,2,4]triazolo[4,3-b]pyridazin-3(2H)-one
6-(3,4-dimethylphenyl)-2-{2-[4-(2-methoxyphenyl)piperazin-1-yl]-2-oxoethyl}[1,2,4]triazolo[4,3-b]pyridazin-3(2H)-one
Compound characteristics
| Compound ID: | M452-1240 |
| Compound Name: | 6-(3,4-dimethylphenyl)-2-{2-[4-(2-methoxyphenyl)piperazin-1-yl]-2-oxoethyl}[1,2,4]triazolo[4,3-b]pyridazin-3(2H)-one |
| Molecular Weight: | 472.55 |
| Molecular Formula: | C26 H28 N6 O3 |
| Smiles: | Cc1ccc(cc1C)C1C=CC2=NN(CC(N3CCN(CC3)c3ccccc3OC)=O)C(N2N=1)=O |
| Stereo: | ACHIRAL |
| logP: | 3.9693 |
| logD: | 3.9689 |
| logSw: | -4.0971 |
| Hydrogen bond acceptors count: | 7 |
| Polar surface area: | 71.739 |
| InChI Key: | CHSDQWBEVCYJQB-UHFFFAOYSA-N |