5-{5-[(3,4-dimethoxybenzene-1-sulfonyl)methyl]furan-2-yl}-3-(3,5-dimethoxyphenyl)-1,2,4-oxadiazole
Chemical Structure Depiction of
5-{5-[(3,4-dimethoxybenzene-1-sulfonyl)methyl]furan-2-yl}-3-(3,5-dimethoxyphenyl)-1,2,4-oxadiazole
5-{5-[(3,4-dimethoxybenzene-1-sulfonyl)methyl]furan-2-yl}-3-(3,5-dimethoxyphenyl)-1,2,4-oxadiazole
Compound characteristics
Compound ID: | F838-0116 |
Compound Name: | 5-{5-[(3,4-dimethoxybenzene-1-sulfonyl)methyl]furan-2-yl}-3-(3,5-dimethoxyphenyl)-1,2,4-oxadiazole |
Molecular Weight: | 486.5 |
Molecular Formula: | C23 H22 N2 O8 S |
Smiles: | COc1cc(cc(c1)OC)c1nc(c2ccc(CS(c3ccc(c(c3)OC)OC)(=O)=O)o2)on1 |
Stereo: | ACHIRAL |
logP: | 3.8995 |
logD: | 3.8995 |
logSw: | -4.1412 |
Hydrogen bond acceptors count: | 12 |
Polar surface area: | 98.599 |
InChI Key: | SBGAWERRZFNZMY-UHFFFAOYSA-N |