methyl 4-{3-[4-(trifluoromethyl)phenyl]-1,2,4-oxadiazol-5-yl}benzoate
Chemical Structure Depiction of
methyl 4-{3-[4-(trifluoromethyl)phenyl]-1,2,4-oxadiazol-5-yl}benzoate
methyl 4-{3-[4-(trifluoromethyl)phenyl]-1,2,4-oxadiazol-5-yl}benzoate
Compound characteristics
| Compound ID: | D041-0175 |
| Compound Name: | methyl 4-{3-[4-(trifluoromethyl)phenyl]-1,2,4-oxadiazol-5-yl}benzoate |
| Molecular Weight: | 348.28 |
| Molecular Formula: | C17 H11 F3 N2 O3 |
| Smiles: | COC(c1ccc(cc1)c1nc(c2ccc(cc2)C(F)(F)F)no1)=O |
| Stereo: | ACHIRAL |
| logP: | 5.1753 |
| logD: | 5.1753 |
| logSw: | -5.2296 |
| Hydrogen bond acceptors count: | 6 |
| Polar surface area: | 52.818 |
| InChI Key: | JXTKFZNKWDNBPZ-UHFFFAOYSA-N |