3-(trifluoromethyl)phenyl 2-ethyl-1-oxo-1,2-dihydroisoquinoline-4-carboxylate
Chemical Structure Depiction of
3-(trifluoromethyl)phenyl 2-ethyl-1-oxo-1,2-dihydroisoquinoline-4-carboxylate
3-(trifluoromethyl)phenyl 2-ethyl-1-oxo-1,2-dihydroisoquinoline-4-carboxylate
Compound characteristics
| Compound ID: | G817-1485 |
| Compound Name: | 3-(trifluoromethyl)phenyl 2-ethyl-1-oxo-1,2-dihydroisoquinoline-4-carboxylate |
| Molecular Weight: | 361.32 |
| Molecular Formula: | C19 H14 F3 N O3 |
| Smiles: | CCN1C=C(C(=O)Oc2cccc(c2)C(F)(F)F)c2ccccc2C1=O |
| Stereo: | ACHIRAL |
| logP: | 3.4232 |
| logD: | 3.4232 |
| logSw: | -3.9479 |
| Hydrogen bond acceptors count: | 5 |
| Polar surface area: | 36.574 |
| InChI Key: | QSKIEMWVPXOTKR-UHFFFAOYSA-N |