ethyl N-{[4-(3-ethoxy-1,1,1-trifluoro-2-hydroxy-3-oxopropan-2-yl)-2-methylphenyl]carbamoyl}-3,3,3-trifluoro-2-(4-fluorophenyl)alaninate
Chemical Structure Depiction of
ethyl N-{[4-(3-ethoxy-1,1,1-trifluoro-2-hydroxy-3-oxopropan-2-yl)-2-methylphenyl]carbamoyl}-3,3,3-trifluoro-2-(4-fluorophenyl)alaninate
ethyl N-{[4-(3-ethoxy-1,1,1-trifluoro-2-hydroxy-3-oxopropan-2-yl)-2-methylphenyl]carbamoyl}-3,3,3-trifluoro-2-(4-fluorophenyl)alaninate
Compound characteristics
Compound ID: | 8019-0792 |
Compound Name: | ethyl N-{[4-(3-ethoxy-1,1,1-trifluoro-2-hydroxy-3-oxopropan-2-yl)-2-methylphenyl]carbamoyl}-3,3,3-trifluoro-2-(4-fluorophenyl)alaninate |
Molecular Weight: | 568.44 |
Molecular Formula: | C24 H23 F7 N2 O6 |
Smiles: | CCOC(C(c1ccc(cc1)F)(C(F)(F)F)NC(Nc1ccc(cc1C)C(C(=O)OCC)(C(F)(F)F)O)=O)=O |
Stereo: | MIXTURE OF STEREOISOMERS |
logP: | 5.3078 |
logD: | 4.4613 |
logSw: | -5.1887 |
Hydrogen bond acceptors count: | 9 |
Hydrogen bond donors count: | 3 |
Polar surface area: | 89.132 |
InChI Key: | RDSSXVKZBLGSJA-UHFFFAOYSA-N |