2-chloro-4-fluorophenyl 1-oxo-2-phenyl-1,2-dihydroisoquinoline-4-carboxylate
Chemical Structure Depiction of
2-chloro-4-fluorophenyl 1-oxo-2-phenyl-1,2-dihydroisoquinoline-4-carboxylate
2-chloro-4-fluorophenyl 1-oxo-2-phenyl-1,2-dihydroisoquinoline-4-carboxylate
Compound characteristics
| Compound ID: | G817-1456 |
| Compound Name: | 2-chloro-4-fluorophenyl 1-oxo-2-phenyl-1,2-dihydroisoquinoline-4-carboxylate |
| Molecular Weight: | 393.8 |
| Molecular Formula: | C22 H13 Cl F N O3 |
| Smiles: | C1=C(C(=O)Oc2ccc(cc2[Cl])F)c2ccccc2C(N1c1ccccc1)=O |
| Stereo: | ACHIRAL |
| logP: | 4.0717 |
| logD: | 4.0717 |
| logSw: | -4.4706 |
| Hydrogen bond acceptors count: | 5 |
| Polar surface area: | 36.219 |
| InChI Key: | CNCOTRNGNWNRIM-UHFFFAOYSA-N |