2-cyano-3-{4-[(4-fluorobenzyl)oxy]phenyl}-N~1~-[5-(trifluoromethyl)-1,3,4-thiadiazol-2-yl]acrylamide
Chemical Structure Depiction of
2-cyano-3-{4-[(4-fluorobenzyl)oxy]phenyl}-N~1~-[5-(trifluoromethyl)-1,3,4-thiadiazol-2-yl]acrylamide
2-cyano-3-{4-[(4-fluorobenzyl)oxy]phenyl}-N~1~-[5-(trifluoromethyl)-1,3,4-thiadiazol-2-yl]acrylamide
Compound characteristics
| Compound ID: | 8013-1194 |
| Compound Name: | 2-cyano-3-{4-[(4-fluorobenzyl)oxy]phenyl}-N~1~-[5-(trifluoromethyl)-1,3,4-thiadiazol-2-yl]acrylamide |
| Molecular Weight: | 448.4 |
| Molecular Formula: | C20 H12 F4 N4 O2 S |
| Smiles: | C(c1ccc(cc1)F)Oc1ccc(/C=C(/C#N)C(Nc2nnc(C(F)(F)F)s2)=O)cc1 |
| Stereo: | ACHIRAL |
| logP: | 5.01 |
| logD: | 0.47 |
| logSw: | -6.13 |
| Hydrogen bond acceptors count: | 6 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 145.01 |
| InChI Key: | XTABHJCNNZWRLR-UHFFFAOYSA-N |