3-{3-[(4-methylbenzene-1-sulfonyl)methyl]-1,2,4-oxadiazol-5-yl}-N-[2-(trifluoromethyl)phenyl]propanamide
Chemical Structure Depiction of
3-{3-[(4-methylbenzene-1-sulfonyl)methyl]-1,2,4-oxadiazol-5-yl}-N-[2-(trifluoromethyl)phenyl]propanamide
3-{3-[(4-methylbenzene-1-sulfonyl)methyl]-1,2,4-oxadiazol-5-yl}-N-[2-(trifluoromethyl)phenyl]propanamide
Compound characteristics
| Compound ID: | G729-0906 |
| Compound Name: | 3-{3-[(4-methylbenzene-1-sulfonyl)methyl]-1,2,4-oxadiazol-5-yl}-N-[2-(trifluoromethyl)phenyl]propanamide |
| Molecular Weight: | 453.44 |
| Molecular Formula: | C20 H18 F3 N3 O4 S |
| Smiles: | Cc1ccc(cc1)S(Cc1nc(CCC(Nc2ccccc2C(F)(F)F)=O)on1)(=O)=O |
| Stereo: | ACHIRAL |
| logP: | 3.3226 |
| logD: | 3.3226 |
| logSw: | -3.8676 |
| Hydrogen bond acceptors count: | 9 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 83.788 |
| InChI Key: | ZGWQZGGWUYEFRS-UHFFFAOYSA-N |