ethyl 3,3,3-trifluoro-2-(2,2,2-trifluoroethoxy)-N-{[4-(1,1,1-trifluoro-2-hydroxy-3-methoxy-3-oxopropan-2-yl)phenyl]carbamoyl}alaninate
Chemical Structure Depiction of
ethyl 3,3,3-trifluoro-2-(2,2,2-trifluoroethoxy)-N-{[4-(1,1,1-trifluoro-2-hydroxy-3-methoxy-3-oxopropan-2-yl)phenyl]carbamoyl}alaninate
ethyl 3,3,3-trifluoro-2-(2,2,2-trifluoroethoxy)-N-{[4-(1,1,1-trifluoro-2-hydroxy-3-methoxy-3-oxopropan-2-yl)phenyl]carbamoyl}alaninate
Compound characteristics
| Compound ID: | 8019-0775 |
| Compound Name: | ethyl 3,3,3-trifluoro-2-(2,2,2-trifluoroethoxy)-N-{[4-(1,1,1-trifluoro-2-hydroxy-3-methoxy-3-oxopropan-2-yl)phenyl]carbamoyl}alaninate |
| Molecular Weight: | 544.33 |
| Molecular Formula: | C18 H17 F9 N2 O7 |
| Smiles: | CCOC(C(C(F)(F)F)(NC(Nc1ccc(cc1)C(C(=O)OC)(C(F)(F)F)O)=O)OCC(F)(F)F)=O |
| Stereo: | MIXTURE OF STEREOISOMERS |
| logP: | 4.0492 |
| logD: | 4.0454 |
| logSw: | -4.1973 |
| Hydrogen bond acceptors count: | 10 |
| Hydrogen bond donors count: | 3 |
| Polar surface area: | 98.26 |
| InChI Key: | JTFFPXJAZUTLAR-UHFFFAOYSA-N |