butyl 2-(4-fluorophenyl)-1-oxo-1,2-dihydroisoquinoline-4-carboxylate
Chemical Structure Depiction of
butyl 2-(4-fluorophenyl)-1-oxo-1,2-dihydroisoquinoline-4-carboxylate
butyl 2-(4-fluorophenyl)-1-oxo-1,2-dihydroisoquinoline-4-carboxylate
Compound characteristics
| Compound ID: | L867-0548 |
| Compound Name: | butyl 2-(4-fluorophenyl)-1-oxo-1,2-dihydroisoquinoline-4-carboxylate |
| Molecular Weight: | 339.36 |
| Molecular Formula: | C20 H18 F N O3 |
| Smiles: | CCCCOC(C1=CN(C(c2ccccc12)=O)c1ccc(cc1)F)=O |
| Stereo: | ACHIRAL |
| logP: | 3.7129 |
| logD: | 3.7129 |
| logSw: | -4.0235 |
| Hydrogen bond acceptors count: | 5 |
| Polar surface area: | 36.802 |
| InChI Key: | KMATVJQLVDBWJL-UHFFFAOYSA-N |