3-[3-(3,4-dimethoxyphenyl)-1,2,4-oxadiazol-5-yl]-1-[3-(methylsulfanyl)phenyl]pyridazin-4(1H)-one
Chemical Structure Depiction of
3-[3-(3,4-dimethoxyphenyl)-1,2,4-oxadiazol-5-yl]-1-[3-(methylsulfanyl)phenyl]pyridazin-4(1H)-one
3-[3-(3,4-dimethoxyphenyl)-1,2,4-oxadiazol-5-yl]-1-[3-(methylsulfanyl)phenyl]pyridazin-4(1H)-one
Compound characteristics
| Compound ID: | M115-0783 |
| Compound Name: | 3-[3-(3,4-dimethoxyphenyl)-1,2,4-oxadiazol-5-yl]-1-[3-(methylsulfanyl)phenyl]pyridazin-4(1H)-one |
| Molecular Weight: | 422.46 |
| Molecular Formula: | C21 H18 N4 O4 S |
| Smiles: | COc1ccc(cc1OC)c1nc(C2C(C=CN(c3cccc(c3)SC)N=2)=O)on1 |
| Stereo: | ACHIRAL |
| logP: | 3.8257 |
| logD: | 3.8257 |
| logSw: | -4.1877 |
| Hydrogen bond acceptors count: | 9 |
| Polar surface area: | 73.315 |
| InChI Key: | SGRWOFYPUMNYCT-UHFFFAOYSA-N |