methyl 3-oxo-2-[3-(trifluoromethyl)phenyl]-2,3-dihydro-1H-isoindole-4-carboxylate
Chemical Structure Depiction of
methyl 3-oxo-2-[3-(trifluoromethyl)phenyl]-2,3-dihydro-1H-isoindole-4-carboxylate
methyl 3-oxo-2-[3-(trifluoromethyl)phenyl]-2,3-dihydro-1H-isoindole-4-carboxylate
Compound characteristics
| Compound ID: | 8016-8558 |
| Compound Name: | methyl 3-oxo-2-[3-(trifluoromethyl)phenyl]-2,3-dihydro-1H-isoindole-4-carboxylate |
| Molecular Weight: | 335.28 |
| Molecular Formula: | C17 H12 F3 N O3 |
| Smiles: | COC(c1cccc2CN(C(c12)=O)c1cccc(c1)C(F)(F)F)=O |
| Stereo: | ACHIRAL |
| logP: | 3.7595 |
| logD: | 3.7595 |
| logSw: | -4.2458 |
| Hydrogen bond acceptors count: | 5 |
| Polar surface area: | 37.613 |
| InChI Key: | MPCSMUWKUBJHSM-UHFFFAOYSA-N |