3,5-dimethylphenyl 2-(4-fluorophenyl)-1-oxo-1,2-dihydroisoquinoline-4-carboxylate
Chemical Structure Depiction of
3,5-dimethylphenyl 2-(4-fluorophenyl)-1-oxo-1,2-dihydroisoquinoline-4-carboxylate
3,5-dimethylphenyl 2-(4-fluorophenyl)-1-oxo-1,2-dihydroisoquinoline-4-carboxylate
Compound characteristics
| Compound ID: | G817-1661 |
| Compound Name: | 3,5-dimethylphenyl 2-(4-fluorophenyl)-1-oxo-1,2-dihydroisoquinoline-4-carboxylate |
| Molecular Weight: | 387.41 |
| Molecular Formula: | C24 H18 F N O3 |
| Smiles: | Cc1cc(C)cc(c1)OC(C1=CN(C(c2ccccc12)=O)c1ccc(cc1)F)=O |
| Stereo: | ACHIRAL |
| logP: | 4.498 |
| logD: | 4.498 |
| logSw: | -4.5133 |
| Hydrogen bond acceptors count: | 5 |
| Polar surface area: | 36.132 |
| InChI Key: | QALNCSPVYZSKHC-UHFFFAOYSA-N |