5-{5-[(3,4-dimethylbenzene-1-sulfonyl)methyl]furan-2-yl}-3-[4-(trifluoromethoxy)phenyl]-1,2,4-oxadiazole
Chemical Structure Depiction of
5-{5-[(3,4-dimethylbenzene-1-sulfonyl)methyl]furan-2-yl}-3-[4-(trifluoromethoxy)phenyl]-1,2,4-oxadiazole
5-{5-[(3,4-dimethylbenzene-1-sulfonyl)methyl]furan-2-yl}-3-[4-(trifluoromethoxy)phenyl]-1,2,4-oxadiazole
Compound characteristics
| Compound ID: | F838-0786 |
| Compound Name: | 5-{5-[(3,4-dimethylbenzene-1-sulfonyl)methyl]furan-2-yl}-3-[4-(trifluoromethoxy)phenyl]-1,2,4-oxadiazole |
| Molecular Weight: | 478.45 |
| Molecular Formula: | C22 H17 F3 N2 O5 S |
| Smiles: | Cc1ccc(cc1C)S(Cc1ccc(c2nc(c3ccc(cc3)OC(F)(F)F)no2)o1)(=O)=O |
| Stereo: | ACHIRAL |
| logP: | 6.5424 |
| logD: | 6.5424 |
| logSw: | -5.8261 |
| Hydrogen bond acceptors count: | 9 |
| Polar surface area: | 74.187 |
| InChI Key: | SXRMBENFFBPGCK-UHFFFAOYSA-N |