ethyl 1-(4-chloroanilino)isoquinoline-4-carboxylate
Chemical Structure Depiction of
ethyl 1-(4-chloroanilino)isoquinoline-4-carboxylate
ethyl 1-(4-chloroanilino)isoquinoline-4-carboxylate
Compound characteristics
| Compound ID: | G780-0599 |
| Compound Name: | ethyl 1-(4-chloroanilino)isoquinoline-4-carboxylate |
| Molecular Weight: | 326.78 |
| Molecular Formula: | C18 H15 Cl N2 O2 |
| Smiles: | CCOC(c1cnc(c2ccccc12)Nc1ccc(cc1)[Cl])=O |
| Stereo: | ACHIRAL |
| logP: | 4.9729 |
| logD: | 4.9728 |
| logSw: | -4.9874 |
| Hydrogen bond acceptors count: | 4 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 39.41 |
| InChI Key: | LZJRSDDGOHMKPZ-UHFFFAOYSA-N |