5-{5-[(3,4-dimethylbenzene-1-sulfonyl)methyl]furan-2-yl}-3-(4-fluorophenyl)-1,2,4-oxadiazole
Chemical Structure Depiction of
5-{5-[(3,4-dimethylbenzene-1-sulfonyl)methyl]furan-2-yl}-3-(4-fluorophenyl)-1,2,4-oxadiazole
5-{5-[(3,4-dimethylbenzene-1-sulfonyl)methyl]furan-2-yl}-3-(4-fluorophenyl)-1,2,4-oxadiazole
Compound characteristics
Compound ID: | F838-0227 |
Compound Name: | 5-{5-[(3,4-dimethylbenzene-1-sulfonyl)methyl]furan-2-yl}-3-(4-fluorophenyl)-1,2,4-oxadiazole |
Molecular Weight: | 412.44 |
Molecular Formula: | C21 H17 F N2 O4 S |
Smiles: | Cc1ccc(cc1C)S(Cc1ccc(c2nc(c3ccc(cc3)F)no2)o1)(=O)=O |
Stereo: | ACHIRAL |
logP: | 5.3802 |
logD: | 5.3802 |
logSw: | -5.5111 |
Hydrogen bond acceptors count: | 8 |
Polar surface area: | 68.25 |
InChI Key: | KHMZAHRSDFOFHH-UHFFFAOYSA-N |