ethyl 1-(4-ethoxyanilino)isoquinoline-4-carboxylate
Chemical Structure Depiction of
ethyl 1-(4-ethoxyanilino)isoquinoline-4-carboxylate
ethyl 1-(4-ethoxyanilino)isoquinoline-4-carboxylate
Compound characteristics
| Compound ID: | G780-0453 |
| Compound Name: | ethyl 1-(4-ethoxyanilino)isoquinoline-4-carboxylate |
| Molecular Weight: | 336.39 |
| Molecular Formula: | C20 H20 N2 O3 |
| Smiles: | CCOC(c1cnc(c2ccccc12)Nc1ccc(cc1)OCC)=O |
| Stereo: | ACHIRAL |
| logP: | 4.7472 |
| logD: | 4.7471 |
| logSw: | -4.5166 |
| Hydrogen bond acceptors count: | 5 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 46.534 |
| InChI Key: | POZOVYHRCSGSFM-UHFFFAOYSA-N |