methyl 3,3,3-trifluoro-2-(4-fluoroanilino)-N-{[4-(trifluoromethoxy)phenyl]carbamoyl}alaninate
Chemical Structure Depiction of
methyl 3,3,3-trifluoro-2-(4-fluoroanilino)-N-{[4-(trifluoromethoxy)phenyl]carbamoyl}alaninate
methyl 3,3,3-trifluoro-2-(4-fluoroanilino)-N-{[4-(trifluoromethoxy)phenyl]carbamoyl}alaninate
Compound characteristics
| Compound ID: | 8012-8896 |
| Compound Name: | methyl 3,3,3-trifluoro-2-(4-fluoroanilino)-N-{[4-(trifluoromethoxy)phenyl]carbamoyl}alaninate |
| Molecular Weight: | 469.31 |
| Molecular Formula: | C18 H14 F7 N3 O4 |
| Smiles: | COC(C(C(F)(F)F)(NC(Nc1ccc(cc1)OC(F)(F)F)=O)Nc1ccc(cc1)F)=O |
| Stereo: | RACEMIC MIXTURE |
| logP: | 5.4709 |
| logD: | 5.445 |
| logSw: | -5.5908 |
| Hydrogen bond acceptors count: | 6 |
| Hydrogen bond donors count: | 3 |
| Polar surface area: | 69.849 |
| InChI Key: | DNBIKAZKBFVDMP-INIZCTEOSA-N |