2-methoxy-2-oxoethyl 2-(3-fluorophenyl)-1-oxo-1,2-dihydroisoquinoline-4-carboxylate
Chemical Structure Depiction of
2-methoxy-2-oxoethyl 2-(3-fluorophenyl)-1-oxo-1,2-dihydroisoquinoline-4-carboxylate
2-methoxy-2-oxoethyl 2-(3-fluorophenyl)-1-oxo-1,2-dihydroisoquinoline-4-carboxylate
Compound characteristics
| Compound ID: | L867-0499 |
| Compound Name: | 2-methoxy-2-oxoethyl 2-(3-fluorophenyl)-1-oxo-1,2-dihydroisoquinoline-4-carboxylate |
| Molecular Weight: | 355.32 |
| Molecular Formula: | C19 H14 F N O5 |
| Smiles: | COC(COC(C1=CN(C(c2ccccc12)=O)c1cccc(c1)F)=O)=O |
| Stereo: | ACHIRAL |
| logP: | 1.6985 |
| logD: | 1.6985 |
| logSw: | -2.3498 |
| Hydrogen bond acceptors count: | 8 |
| Polar surface area: | 57.463 |
| InChI Key: | XBALHEXWFAQCMB-UHFFFAOYSA-N |