ethyl N-[(3-chloro-4-fluorophenyl)carbamoyl]-3,3,3-trifluoro-2-(2,2,2-trifluoroethoxy)alaninate
Chemical Structure Depiction of
ethyl N-[(3-chloro-4-fluorophenyl)carbamoyl]-3,3,3-trifluoro-2-(2,2,2-trifluoroethoxy)alaninate
ethyl N-[(3-chloro-4-fluorophenyl)carbamoyl]-3,3,3-trifluoro-2-(2,2,2-trifluoroethoxy)alaninate
Compound characteristics
| Compound ID: | 8019-0756 |
| Compound Name: | ethyl N-[(3-chloro-4-fluorophenyl)carbamoyl]-3,3,3-trifluoro-2-(2,2,2-trifluoroethoxy)alaninate |
| Molecular Weight: | 440.7 |
| Molecular Formula: | C14 H12 Cl F7 N2 O4 |
| Smiles: | CCOC(C(C(F)(F)F)(NC(Nc1ccc(c(c1)[Cl])F)=O)OCC(F)(F)F)=O |
| Stereo: | RACEMIC MIXTURE |
| logP: | 4.8864 |
| logD: | 4.8541 |
| logSw: | -4.9127 |
| Hydrogen bond acceptors count: | 6 |
| Hydrogen bond donors count: | 2 |
| Polar surface area: | 62.018 |
| InChI Key: | LJRMJWVDSMUVRK-CYBMUJFWSA-N |