2-{[3-(2,3-dimethoxyphenyl)-1,2,4-oxadiazol-5-yl]methyl}-6-(3,4-dimethylphenyl)[1,2,4]triazolo[4,3-b]pyridazin-3(2H)-one
Chemical Structure Depiction of
2-{[3-(2,3-dimethoxyphenyl)-1,2,4-oxadiazol-5-yl]methyl}-6-(3,4-dimethylphenyl)[1,2,4]triazolo[4,3-b]pyridazin-3(2H)-one
2-{[3-(2,3-dimethoxyphenyl)-1,2,4-oxadiazol-5-yl]methyl}-6-(3,4-dimethylphenyl)[1,2,4]triazolo[4,3-b]pyridazin-3(2H)-one
Compound characteristics
| Compound ID: | M453-0794 |
| Compound Name: | 2-{[3-(2,3-dimethoxyphenyl)-1,2,4-oxadiazol-5-yl]methyl}-6-(3,4-dimethylphenyl)[1,2,4]triazolo[4,3-b]pyridazin-3(2H)-one |
| Molecular Weight: | 458.48 |
| Molecular Formula: | C24 H22 N6 O4 |
| Smiles: | Cc1ccc(cc1C)C1C=CC2=NN(Cc3nc(c4cccc(c4OC)OC)no3)C(N2N=1)=O |
| Stereo: | ACHIRAL |
| logP: | 4.8151 |
| logD: | 4.8151 |
| logSw: | -4.6368 |
| Hydrogen bond acceptors count: | 9 |
| Polar surface area: | 91.447 |
| InChI Key: | NUCARZCKKPLTJV-UHFFFAOYSA-N |