4-[3-(2-methylphenyl)-1,2,4-oxadiazol-5-yl]phenyl benzoate
Chemical Structure Depiction of
4-[3-(2-methylphenyl)-1,2,4-oxadiazol-5-yl]phenyl benzoate
4-[3-(2-methylphenyl)-1,2,4-oxadiazol-5-yl]phenyl benzoate
Compound characteristics
| Compound ID: | K086-0088 |
| Compound Name: | 4-[3-(2-methylphenyl)-1,2,4-oxadiazol-5-yl]phenyl benzoate |
| Molecular Weight: | 356.38 |
| Molecular Formula: | C22 H16 N2 O3 |
| Smiles: | Cc1ccccc1c1nc(c2ccc(cc2)OC(c2ccccc2)=O)on1 |
| Stereo: | ACHIRAL |
| logP: | 5.2241 |
| logD: | 5.2241 |
| logSw: | -5.1626 |
| Hydrogen bond acceptors count: | 6 |
| Polar surface area: | 52.022 |
| InChI Key: | QFBSIKRCXPBFSW-UHFFFAOYSA-N |