2-cyano-3-[3-methoxy-4-(1-phenylethoxy)phenyl]-N~1~-[5-(trifluoromethyl)-1,3,4-thiadiazol-2-yl]acrylamide
Chemical Structure Depiction of
2-cyano-3-[3-methoxy-4-(1-phenylethoxy)phenyl]-N~1~-[5-(trifluoromethyl)-1,3,4-thiadiazol-2-yl]acrylamide
2-cyano-3-[3-methoxy-4-(1-phenylethoxy)phenyl]-N~1~-[5-(trifluoromethyl)-1,3,4-thiadiazol-2-yl]acrylamide
Compound characteristics
| Compound ID: | 3948-0662 |
| Compound Name: | 2-cyano-3-[3-methoxy-4-(1-phenylethoxy)phenyl]-N~1~-[5-(trifluoromethyl)-1,3,4-thiadiazol-2-yl]acrylamide |
| Molecular Weight: | 474.46 |
| Molecular Formula: | C22 H17 F3 N4 O3 S |
| Smiles: | CC(c1ccccc1)Oc1ccc(/C=C(/C#N)C(Nc2nnc(C(F)(F)F)s2)=O)cc1OC |
| Stereo: | RACEMIC MIXTURE |
| logP: | 5.42 |
| logD: | 0.89 |
| logSw: | -6.31 |
| Hydrogen bond acceptors count: | 7 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 156.63 |
| InChI Key: | WXADRXAPSOQZLZ-ZDUSSCGKSA-N |