5-{5-[(3,4-dimethoxybenzene-1-sulfonyl)methyl]furan-2-yl}-3-[4-(methylsulfanyl)phenyl]-1,2,4-oxadiazole
Chemical Structure Depiction of
5-{5-[(3,4-dimethoxybenzene-1-sulfonyl)methyl]furan-2-yl}-3-[4-(methylsulfanyl)phenyl]-1,2,4-oxadiazole
5-{5-[(3,4-dimethoxybenzene-1-sulfonyl)methyl]furan-2-yl}-3-[4-(methylsulfanyl)phenyl]-1,2,4-oxadiazole
Compound characteristics
| Compound ID: | F838-0117 |
| Compound Name: | 5-{5-[(3,4-dimethoxybenzene-1-sulfonyl)methyl]furan-2-yl}-3-[4-(methylsulfanyl)phenyl]-1,2,4-oxadiazole |
| Molecular Weight: | 472.54 |
| Molecular Formula: | C22 H20 N2 O6 S2 |
| Smiles: | COc1ccc(cc1OC)S(Cc1ccc(c2nc(c3ccc(cc3)SC)no2)o1)(=O)=O |
| Stereo: | ACHIRAL |
| logP: | 4.6518 |
| logD: | 4.6518 |
| logSw: | -4.5673 |
| Hydrogen bond acceptors count: | 11 |
| Polar surface area: | 83.511 |
| InChI Key: | RULPJGAFNFXYLR-UHFFFAOYSA-N |