3-{3-[(4-methylbenzene-1-sulfonyl)methyl]-1,2,4-oxadiazol-5-yl}-N-[3-(trifluoromethyl)phenyl]propanamide
Chemical Structure Depiction of
3-{3-[(4-methylbenzene-1-sulfonyl)methyl]-1,2,4-oxadiazol-5-yl}-N-[3-(trifluoromethyl)phenyl]propanamide
3-{3-[(4-methylbenzene-1-sulfonyl)methyl]-1,2,4-oxadiazol-5-yl}-N-[3-(trifluoromethyl)phenyl]propanamide
Compound characteristics
| Compound ID: | G729-0907 |
| Compound Name: | 3-{3-[(4-methylbenzene-1-sulfonyl)methyl]-1,2,4-oxadiazol-5-yl}-N-[3-(trifluoromethyl)phenyl]propanamide |
| Molecular Weight: | 453.44 |
| Molecular Formula: | C20 H18 F3 N3 O4 S |
| Smiles: | Cc1ccc(cc1)S(Cc1nc(CCC(Nc2cccc(c2)C(F)(F)F)=O)on1)(=O)=O |
| Stereo: | ACHIRAL |
| logP: | 3.8503 |
| logD: | 3.8494 |
| logSw: | -3.944 |
| Hydrogen bond acceptors count: | 9 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 84.486 |
| InChI Key: | VKZPXEPGABREKJ-UHFFFAOYSA-N |