3-(4-methylphenyl)-5-{5-[(2,4,5-trimethylbenzene-1-sulfonyl)methyl]furan-2-yl}-1,2,4-oxadiazole
Chemical Structure Depiction of
3-(4-methylphenyl)-5-{5-[(2,4,5-trimethylbenzene-1-sulfonyl)methyl]furan-2-yl}-1,2,4-oxadiazole
3-(4-methylphenyl)-5-{5-[(2,4,5-trimethylbenzene-1-sulfonyl)methyl]furan-2-yl}-1,2,4-oxadiazole
Compound characteristics
| Compound ID: | F838-0364 |
| Compound Name: | 3-(4-methylphenyl)-5-{5-[(2,4,5-trimethylbenzene-1-sulfonyl)methyl]furan-2-yl}-1,2,4-oxadiazole |
| Molecular Weight: | 422.5 |
| Molecular Formula: | C23 H22 N2 O4 S |
| Smiles: | Cc1ccc(cc1)c1nc(c2ccc(CS(c3cc(C)c(C)cc3C)(=O)=O)o2)on1 |
| Stereo: | ACHIRAL |
| logP: | 6.4039 |
| logD: | 6.4039 |
| logSw: | -5.7297 |
| Hydrogen bond acceptors count: | 8 |
| Polar surface area: | 68.25 |
| InChI Key: | ZXCQSARAFFDSGW-UHFFFAOYSA-N |