1-(3,4-dimethylphenyl)-3-{3-[4-(methylsulfanyl)phenyl]-1,2,4-oxadiazol-5-yl}pyridazin-4(1H)-one
Chemical Structure Depiction of
1-(3,4-dimethylphenyl)-3-{3-[4-(methylsulfanyl)phenyl]-1,2,4-oxadiazol-5-yl}pyridazin-4(1H)-one
1-(3,4-dimethylphenyl)-3-{3-[4-(methylsulfanyl)phenyl]-1,2,4-oxadiazol-5-yl}pyridazin-4(1H)-one
Compound characteristics
| Compound ID: | M115-0185 |
| Compound Name: | 1-(3,4-dimethylphenyl)-3-{3-[4-(methylsulfanyl)phenyl]-1,2,4-oxadiazol-5-yl}pyridazin-4(1H)-one |
| Molecular Weight: | 390.46 |
| Molecular Formula: | C21 H18 N4 O2 S |
| Smiles: | Cc1ccc(cc1C)N1C=CC(C(c2nc(c3ccc(cc3)SC)no2)=N1)=O |
| Stereo: | ACHIRAL |
| logP: | 5.6268 |
| logD: | 5.6268 |
| logSw: | -5.4583 |
| Hydrogen bond acceptors count: | 7 |
| Polar surface area: | 58.055 |
| InChI Key: | CXUZCAGIPKDYAN-UHFFFAOYSA-N |