3-chlorophenyl 2-(4-fluorophenyl)-1-oxo-1,2-dihydroisoquinoline-4-carboxylate
Chemical Structure Depiction of
3-chlorophenyl 2-(4-fluorophenyl)-1-oxo-1,2-dihydroisoquinoline-4-carboxylate
3-chlorophenyl 2-(4-fluorophenyl)-1-oxo-1,2-dihydroisoquinoline-4-carboxylate
Compound characteristics
| Compound ID: | G817-1653 |
| Compound Name: | 3-chlorophenyl 2-(4-fluorophenyl)-1-oxo-1,2-dihydroisoquinoline-4-carboxylate |
| Molecular Weight: | 393.8 |
| Molecular Formula: | C22 H13 Cl F N O3 |
| Smiles: | C1=C(C(=O)Oc2cccc(c2)[Cl])c2ccccc2C(N1c1ccc(cc1)F)=O |
| Stereo: | ACHIRAL |
| logP: | 4.4253 |
| logD: | 4.4253 |
| logSw: | -4.6688 |
| Hydrogen bond acceptors count: | 5 |
| Polar surface area: | 36.132 |
| InChI Key: | WGQIZDPEMCRCEV-UHFFFAOYSA-N |