methyl 4-(2-fluoro-5-methylanilino)-2-hydroxy-4-oxo-2-(trifluoromethyl)butanoate
Chemical Structure Depiction of
methyl 4-(2-fluoro-5-methylanilino)-2-hydroxy-4-oxo-2-(trifluoromethyl)butanoate
methyl 4-(2-fluoro-5-methylanilino)-2-hydroxy-4-oxo-2-(trifluoromethyl)butanoate
Compound characteristics
| Compound ID: | Y509-0852 |
| Compound Name: | methyl 4-(2-fluoro-5-methylanilino)-2-hydroxy-4-oxo-2-(trifluoromethyl)butanoate |
| Molecular Weight: | 323.24 |
| Molecular Formula: | C13 H13 F4 N O4 |
| Smiles: | Cc1ccc(c(c1)NC(CC(C(=O)OC)(C(F)(F)F)O)=O)F |
| Stereo: | RACEMIC MIXTURE |
| logP: | 1.8586 |
| logD: | 1.8583 |
| logSw: | -2.2982 |
| Hydrogen bond acceptors count: | 6 |
| Hydrogen bond donors count: | 2 |
| Polar surface area: | 59.399 |
| InChI Key: | KJVLJITZHBWMOB-GFCCVEGCSA-N |