3-(3,4-dimethoxyphenyl)-5-{5-[(4-methylbenzene-1-sulfonyl)methyl]furan-2-yl}-1,2,4-oxadiazole
Chemical Structure Depiction of
3-(3,4-dimethoxyphenyl)-5-{5-[(4-methylbenzene-1-sulfonyl)methyl]furan-2-yl}-1,2,4-oxadiazole
3-(3,4-dimethoxyphenyl)-5-{5-[(4-methylbenzene-1-sulfonyl)methyl]furan-2-yl}-1,2,4-oxadiazole
Compound characteristics
| Compound ID: | F838-0045 |
| Compound Name: | 3-(3,4-dimethoxyphenyl)-5-{5-[(4-methylbenzene-1-sulfonyl)methyl]furan-2-yl}-1,2,4-oxadiazole |
| Molecular Weight: | 440.47 |
| Molecular Formula: | C22 H20 N2 O6 S |
| Smiles: | Cc1ccc(cc1)S(Cc1ccc(c2nc(c3ccc(c(c3)OC)OC)no2)o1)(=O)=O |
| Stereo: | ACHIRAL |
| logP: | 4.4356 |
| logD: | 4.4356 |
| logSw: | -4.4034 |
| Hydrogen bond acceptors count: | 10 |
| Polar surface area: | 83.511 |
| InChI Key: | SKQKCHYDHRZURL-UHFFFAOYSA-N |