methyl 2-(5-chloro-2-methoxyanilino)-3,3,3-trifluoro-N-{[4-(trifluoromethoxy)phenyl]carbamoyl}alaninate
Chemical Structure Depiction of
methyl 2-(5-chloro-2-methoxyanilino)-3,3,3-trifluoro-N-{[4-(trifluoromethoxy)phenyl]carbamoyl}alaninate
methyl 2-(5-chloro-2-methoxyanilino)-3,3,3-trifluoro-N-{[4-(trifluoromethoxy)phenyl]carbamoyl}alaninate
Compound characteristics
| Compound ID: | 8012-9609 |
| Compound Name: | methyl 2-(5-chloro-2-methoxyanilino)-3,3,3-trifluoro-N-{[4-(trifluoromethoxy)phenyl]carbamoyl}alaninate |
| Molecular Weight: | 515.79 |
| Molecular Formula: | C19 H16 Cl F6 N3 O5 |
| Smiles: | COC(C(C(F)(F)F)(NC(Nc1ccc(cc1)OC(F)(F)F)=O)Nc1cc(ccc1OC)[Cl])=O |
| Stereo: | RACEMIC MIXTURE |
| logP: | 5.9541 |
| logD: | 5.9408 |
| logSw: | -6.2259 |
| Hydrogen bond acceptors count: | 7 |
| Hydrogen bond donors count: | 3 |
| Polar surface area: | 76.782 |
| InChI Key: | FETWTFSLDOIBAQ-KRWDZBQOSA-N |