3-phenyl-5-[(2,4,5-trimethylbenzene-1-sulfonyl)methyl]-1,2,4-oxadiazole
Chemical Structure Depiction of
3-phenyl-5-[(2,4,5-trimethylbenzene-1-sulfonyl)methyl]-1,2,4-oxadiazole
3-phenyl-5-[(2,4,5-trimethylbenzene-1-sulfonyl)methyl]-1,2,4-oxadiazole
Compound characteristics
| Compound ID: | L106-0022 |
| Compound Name: | 3-phenyl-5-[(2,4,5-trimethylbenzene-1-sulfonyl)methyl]-1,2,4-oxadiazole |
| Molecular Weight: | 342.41 |
| Molecular Formula: | C18 H18 N2 O3 S |
| Smiles: | Cc1cc(C)c(cc1C)S(Cc1nc(c2ccccc2)no1)(=O)=O |
| Stereo: | ACHIRAL |
| logP: | 4.7864 |
| logD: | 4.7864 |
| logSw: | -4.658 |
| Hydrogen bond acceptors count: | 7 |
| Polar surface area: | 60.346 |
| InChI Key: | QMJLACOBBMHDPL-UHFFFAOYSA-N |