5-{5-[(benzenesulfonyl)methyl]furan-2-yl}-3-(3,4,5-trimethoxyphenyl)-1,2,4-oxadiazole
Chemical Structure Depiction of
5-{5-[(benzenesulfonyl)methyl]furan-2-yl}-3-(3,4,5-trimethoxyphenyl)-1,2,4-oxadiazole
5-{5-[(benzenesulfonyl)methyl]furan-2-yl}-3-(3,4,5-trimethoxyphenyl)-1,2,4-oxadiazole
Compound characteristics
Compound ID: | F838-0661 |
Compound Name: | 5-{5-[(benzenesulfonyl)methyl]furan-2-yl}-3-(3,4,5-trimethoxyphenyl)-1,2,4-oxadiazole |
Molecular Weight: | 456.47 |
Molecular Formula: | C22 H20 N2 O7 S |
Smiles: | COc1cc(cc(c1OC)OC)c1nc(c2ccc(CS(c3ccccc3)(=O)=O)o2)on1 |
Stereo: | ACHIRAL |
logP: | 3.6871 |
logD: | 3.6871 |
logSw: | -4.0249 |
Hydrogen bond acceptors count: | 11 |
Polar surface area: | 91.228 |
InChI Key: | UDMVQLZFEMQDOV-UHFFFAOYSA-N |