3-chlorophenyl 2-ethyl-1-oxo-1,2-dihydroisoquinoline-4-carboxylate
Chemical Structure Depiction of
3-chlorophenyl 2-ethyl-1-oxo-1,2-dihydroisoquinoline-4-carboxylate
3-chlorophenyl 2-ethyl-1-oxo-1,2-dihydroisoquinoline-4-carboxylate
Compound characteristics
| Compound ID: | G817-1490 |
| Compound Name: | 3-chlorophenyl 2-ethyl-1-oxo-1,2-dihydroisoquinoline-4-carboxylate |
| Molecular Weight: | 327.77 |
| Molecular Formula: | C18 H14 Cl N O3 |
| Smiles: | CCN1C=C(C(=O)Oc2cccc(c2)[Cl])c2ccccc2C1=O |
| Stereo: | ACHIRAL |
| logP: | 3.3961 |
| logD: | 3.3961 |
| logSw: | -3.7816 |
| Hydrogen bond acceptors count: | 5 |
| Polar surface area: | 36.574 |
| InChI Key: | LGFFYVDGYBIUDL-UHFFFAOYSA-N |