3-[(3,5-dimethylphenyl)methyl]-2-methyl-4-oxo-4-[4-(trifluoromethoxy)anilino]butanoic acid
Chemical Structure Depiction of
3-[(3,5-dimethylphenyl)methyl]-2-methyl-4-oxo-4-[4-(trifluoromethoxy)anilino]butanoic acid
3-[(3,5-dimethylphenyl)methyl]-2-methyl-4-oxo-4-[4-(trifluoromethoxy)anilino]butanoic acid
Compound characteristics
| Compound ID: | 8015-9049 |
| Compound Name: | 3-[(3,5-dimethylphenyl)methyl]-2-methyl-4-oxo-4-[4-(trifluoromethoxy)anilino]butanoic acid |
| Molecular Weight: | 409.4 |
| Molecular Formula: | C21 H22 F3 N O4 |
| Smiles: | CC(C(Cc1cc(C)cc(C)c1)C(Nc1ccc(cc1)OC(F)(F)F)=O)C(O)=O |
| Stereo: | MIXTURE OF STEREOISOMERS |
| logP: | 5.3278 |
| logD: | 2.9186 |
| logSw: | -5.1974 |
| Hydrogen bond acceptors count: | 6 |
| Hydrogen bond donors count: | 2 |
| Polar surface area: | 57.674 |
| InChI Key: | LCZLECYRVQXITQ-UHFFFAOYSA-N |