3-(4-chlorophenyl)-5-{5-[(3,4-dimethoxybenzene-1-sulfonyl)methyl]furan-2-yl}-1,2,4-oxadiazole
Chemical Structure Depiction of
3-(4-chlorophenyl)-5-{5-[(3,4-dimethoxybenzene-1-sulfonyl)methyl]furan-2-yl}-1,2,4-oxadiazole
3-(4-chlorophenyl)-5-{5-[(3,4-dimethoxybenzene-1-sulfonyl)methyl]furan-2-yl}-1,2,4-oxadiazole
Compound characteristics
| Compound ID: | F838-0099 |
| Compound Name: | 3-(4-chlorophenyl)-5-{5-[(3,4-dimethoxybenzene-1-sulfonyl)methyl]furan-2-yl}-1,2,4-oxadiazole |
| Molecular Weight: | 460.89 |
| Molecular Formula: | C21 H17 Cl N2 O6 S |
| Smiles: | COc1ccc(cc1OC)S(Cc1ccc(c2nc(c3ccc(cc3)[Cl])no2)o1)(=O)=O |
| Stereo: | ACHIRAL |
| logP: | 4.5272 |
| logD: | 4.5272 |
| logSw: | -4.7899 |
| Hydrogen bond acceptors count: | 10 |
| Polar surface area: | 83.511 |
| InChI Key: | KWPSLEWHWLDMQS-UHFFFAOYSA-N |