5-[(2,4-dimethylbenzene-1-sulfonyl)methyl]-3-(2-methylphenyl)-1,2,4-oxadiazole
Chemical Structure Depiction of
5-[(2,4-dimethylbenzene-1-sulfonyl)methyl]-3-(2-methylphenyl)-1,2,4-oxadiazole
5-[(2,4-dimethylbenzene-1-sulfonyl)methyl]-3-(2-methylphenyl)-1,2,4-oxadiazole
Compound characteristics
| Compound ID: | L106-0170 |
| Compound Name: | 5-[(2,4-dimethylbenzene-1-sulfonyl)methyl]-3-(2-methylphenyl)-1,2,4-oxadiazole |
| Molecular Weight: | 342.41 |
| Molecular Formula: | C18 H18 N2 O3 S |
| Smiles: | Cc1ccc(c(C)c1)S(Cc1nc(c2ccccc2C)no1)(=O)=O |
| Stereo: | ACHIRAL |
| logP: | 4.4507 |
| logD: | 4.4507 |
| logSw: | -4.4274 |
| Hydrogen bond acceptors count: | 7 |
| Polar surface area: | 60.346 |
| InChI Key: | CHACZGDAGHLHHM-UHFFFAOYSA-N |