3-(2H-1,3-benzodioxol-5-yl)-5-{5-[(4-methoxybenzene-1-sulfonyl)methyl]furan-2-yl}-1,2,4-oxadiazole
Chemical Structure Depiction of
3-(2H-1,3-benzodioxol-5-yl)-5-{5-[(4-methoxybenzene-1-sulfonyl)methyl]furan-2-yl}-1,2,4-oxadiazole
3-(2H-1,3-benzodioxol-5-yl)-5-{5-[(4-methoxybenzene-1-sulfonyl)methyl]furan-2-yl}-1,2,4-oxadiazole
Compound characteristics
| Compound ID: | F838-0185 |
| Compound Name: | 3-(2H-1,3-benzodioxol-5-yl)-5-{5-[(4-methoxybenzene-1-sulfonyl)methyl]furan-2-yl}-1,2,4-oxadiazole |
| Molecular Weight: | 440.43 |
| Molecular Formula: | C21 H16 N2 O7 S |
| Smiles: | COc1ccc(cc1)S(Cc1ccc(c2nc(c3ccc4c(c3)OCO4)no2)o1)(=O)=O |
| Stereo: | ACHIRAL |
| logP: | 4.2927 |
| logD: | 4.2927 |
| logSw: | -4.4369 |
| Hydrogen bond acceptors count: | 11 |
| Polar surface area: | 92.91 |
| InChI Key: | MQXYSWRORLLIJN-UHFFFAOYSA-N |