ethyl N-{[4-(3-ethoxy-1,1,1-trifluoro-2-hydroxy-3-oxopropan-2-yl)phenyl]carbamoyl}-3,3,3-trifluoro-2-(2,2,2-trifluoroethoxy)alaninate
Chemical Structure Depiction of
ethyl N-{[4-(3-ethoxy-1,1,1-trifluoro-2-hydroxy-3-oxopropan-2-yl)phenyl]carbamoyl}-3,3,3-trifluoro-2-(2,2,2-trifluoroethoxy)alaninate
ethyl N-{[4-(3-ethoxy-1,1,1-trifluoro-2-hydroxy-3-oxopropan-2-yl)phenyl]carbamoyl}-3,3,3-trifluoro-2-(2,2,2-trifluoroethoxy)alaninate
Compound characteristics
| Compound ID: | 8019-0774 |
| Compound Name: | ethyl N-{[4-(3-ethoxy-1,1,1-trifluoro-2-hydroxy-3-oxopropan-2-yl)phenyl]carbamoyl}-3,3,3-trifluoro-2-(2,2,2-trifluoroethoxy)alaninate |
| Molecular Weight: | 558.35 |
| Molecular Formula: | C19 H19 F9 N2 O7 |
| Smiles: | CCOC(C(c1ccc(cc1)NC(NC(C(=O)OCC)(C(F)(F)F)OCC(F)(F)F)=O)(C(F)(F)F)O)=O |
| Stereo: | MIXTURE OF STEREOISOMERS |
| logP: | 4.4425 |
| logD: | 4.4386 |
| logSw: | -4.2498 |
| Hydrogen bond acceptors count: | 10 |
| Hydrogen bond donors count: | 3 |
| Polar surface area: | 97.84 |
| InChI Key: | JKSCGKQXAXPSKX-UHFFFAOYSA-N |