5-{5-[(4-chlorobenzene-1-sulfonyl)methyl]furan-2-yl}-3-(3-ethoxyphenyl)-1,2,4-oxadiazole
Chemical Structure Depiction of
5-{5-[(4-chlorobenzene-1-sulfonyl)methyl]furan-2-yl}-3-(3-ethoxyphenyl)-1,2,4-oxadiazole
5-{5-[(4-chlorobenzene-1-sulfonyl)methyl]furan-2-yl}-3-(3-ethoxyphenyl)-1,2,4-oxadiazole
Compound characteristics
Compound ID: | F838-0680 |
Compound Name: | 5-{5-[(4-chlorobenzene-1-sulfonyl)methyl]furan-2-yl}-3-(3-ethoxyphenyl)-1,2,4-oxadiazole |
Molecular Weight: | 444.89 |
Molecular Formula: | C21 H17 Cl N2 O5 S |
Smiles: | CCOc1cccc(c1)c1nc(c2ccc(CS(c3ccc(cc3)[Cl])(=O)=O)o2)on1 |
Stereo: | ACHIRAL |
logP: | 5.4323 |
logD: | 5.4323 |
logSw: | -6.0568 |
Hydrogen bond acceptors count: | 9 |
Polar surface area: | 75.374 |
InChI Key: | IWKLUYMGZZIUHT-UHFFFAOYSA-N |