3-oxo-2-[3-(trifluoromethyl)phenyl]-2,3-dihydro-1H-isoindole-4-carboxylic acid
Chemical Structure Depiction of
3-oxo-2-[3-(trifluoromethyl)phenyl]-2,3-dihydro-1H-isoindole-4-carboxylic acid
3-oxo-2-[3-(trifluoromethyl)phenyl]-2,3-dihydro-1H-isoindole-4-carboxylic acid
Compound characteristics
| Compound ID: | 8017-6057 |
| Compound Name: | 3-oxo-2-[3-(trifluoromethyl)phenyl]-2,3-dihydro-1H-isoindole-4-carboxylic acid |
| Molecular Weight: | 321.25 |
| Molecular Formula: | C16 H10 F3 N O3 |
| Smiles: | C1c2cccc(C(O)=O)c2C(N1c1cccc(c1)C(F)(F)F)=O |
| Stereo: | ACHIRAL |
| logP: | 3.5199 |
| logD: | -0.6933 |
| logSw: | -3.8604 |
| Hydrogen bond acceptors count: | 5 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 44.847 |
| InChI Key: | UXSWDXQOTCKQJK-UHFFFAOYSA-N |