2-ethoxy-2-oxoethyl 2-(4-ethylphenyl)-1-oxo-1,2-dihydroisoquinoline-4-carboxylate
Chemical Structure Depiction of
2-ethoxy-2-oxoethyl 2-(4-ethylphenyl)-1-oxo-1,2-dihydroisoquinoline-4-carboxylate
2-ethoxy-2-oxoethyl 2-(4-ethylphenyl)-1-oxo-1,2-dihydroisoquinoline-4-carboxylate
Compound characteristics
| Compound ID: | L867-0258 |
| Compound Name: | 2-ethoxy-2-oxoethyl 2-(4-ethylphenyl)-1-oxo-1,2-dihydroisoquinoline-4-carboxylate |
| Molecular Weight: | 379.41 |
| Molecular Formula: | C22 H21 N O5 |
| Smiles: | CCc1ccc(cc1)N1C=C(C(=O)OCC(=O)OCC)c2ccccc2C1=O |
| Stereo: | ACHIRAL |
| logP: | 3.0043 |
| logD: | 3.0043 |
| logSw: | -3.341 |
| Hydrogen bond acceptors count: | 8 |
| Polar surface area: | 57.042 |
| InChI Key: | RXDGMBHIWYXTBM-UHFFFAOYSA-N |