3-(4-{2-[4-(acetylamino)phenoxy]ethoxy}phenyl)-2-cyano-N~1~-[5-(trifluoromethyl)-1,3,4-thiadiazol-2-yl]acrylamide
Chemical Structure Depiction of
3-(4-{2-[4-(acetylamino)phenoxy]ethoxy}phenyl)-2-cyano-N~1~-[5-(trifluoromethyl)-1,3,4-thiadiazol-2-yl]acrylamide
3-(4-{2-[4-(acetylamino)phenoxy]ethoxy}phenyl)-2-cyano-N~1~-[5-(trifluoromethyl)-1,3,4-thiadiazol-2-yl]acrylamide
Compound characteristics
| Compound ID: | C469-0409 |
| Compound Name: | 3-(4-{2-[4-(acetylamino)phenoxy]ethoxy}phenyl)-2-cyano-N~1~-[5-(trifluoromethyl)-1,3,4-thiadiazol-2-yl]acrylamide |
| Molecular Weight: | 517.49 |
| Molecular Formula: | C23 H18 F3 N5 O4 S |
| Smiles: | CC(Nc1ccc(cc1)OCCOc1ccc(/C=C(/C#N)C(Nc2nnc(C(F)(F)F)s2)=O)cc1)=O |
| Stereo: | ACHIRAL |
| logP: | 4.23 |
| logD: | -0.3 |
| logSw: | -5.25 |
| Hydrogen bond acceptors count: | 9 |
| Hydrogen bond donors count: | 2 |
| Polar surface area: | 207.43 |
| InChI Key: | VOZGYNBFSWAHNA-UHFFFAOYSA-N |