5-[(2,4-dimethylbenzene-1-sulfonyl)methyl]-3-(4-methylphenyl)-1,2,4-oxadiazole
Chemical Structure Depiction of
5-[(2,4-dimethylbenzene-1-sulfonyl)methyl]-3-(4-methylphenyl)-1,2,4-oxadiazole
5-[(2,4-dimethylbenzene-1-sulfonyl)methyl]-3-(4-methylphenyl)-1,2,4-oxadiazole
Compound characteristics
| Compound ID: | L106-0040 |
| Compound Name: | 5-[(2,4-dimethylbenzene-1-sulfonyl)methyl]-3-(4-methylphenyl)-1,2,4-oxadiazole |
| Molecular Weight: | 342.41 |
| Molecular Formula: | C18 H18 N2 O3 S |
| Smiles: | Cc1ccc(cc1)c1nc(CS(c2ccc(C)cc2C)(=O)=O)on1 |
| Stereo: | ACHIRAL |
| logP: | 4.8562 |
| logD: | 4.8562 |
| logSw: | -4.6062 |
| Hydrogen bond acceptors count: | 7 |
| Polar surface area: | 60.346 |
| InChI Key: | HDINSIMGQANSHT-UHFFFAOYSA-N |