5-[(4-methylbenzene-1-sulfonyl)methyl]-3-phenyl-1,2,4-oxadiazole
Chemical Structure Depiction of
5-[(4-methylbenzene-1-sulfonyl)methyl]-3-phenyl-1,2,4-oxadiazole
5-[(4-methylbenzene-1-sulfonyl)methyl]-3-phenyl-1,2,4-oxadiazole
Compound characteristics
| Compound ID: | L106-0002 |
| Compound Name: | 5-[(4-methylbenzene-1-sulfonyl)methyl]-3-phenyl-1,2,4-oxadiazole |
| Molecular Weight: | 314.36 |
| Molecular Formula: | C16 H14 N2 O3 S |
| Smiles: | Cc1ccc(cc1)S(Cc1nc(c2ccccc2)no1)(=O)=O |
| Stereo: | ACHIRAL |
| logP: | 3.619 |
| logD: | 3.619 |
| logSw: | -3.6335 |
| Hydrogen bond acceptors count: | 7 |
| Polar surface area: | 60.346 |
| InChI Key: | VAGNXIKYOJCPOP-UHFFFAOYSA-N |