ethyl 4-(2-bromo-4-methylanilino)-6-ethoxyquinoline-3-carboxylate
Chemical Structure Depiction of
ethyl 4-(2-bromo-4-methylanilino)-6-ethoxyquinoline-3-carboxylate
ethyl 4-(2-bromo-4-methylanilino)-6-ethoxyquinoline-3-carboxylate
Compound characteristics
| Compound ID: | C053-0565 |
| Compound Name: | ethyl 4-(2-bromo-4-methylanilino)-6-ethoxyquinoline-3-carboxylate |
| Molecular Weight: | 429.31 |
| Molecular Formula: | C21 H21 Br N2 O3 |
| Smiles: | CCOC(c1cnc2ccc(cc2c1Nc1ccc(C)cc1[Br])OCC)=O |
| Stereo: | ACHIRAL |
| logP: | 5.89 |
| logD: | 5.8891 |
| logSw: | -5.4525 |
| Hydrogen bond acceptors count: | 5 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 43.787 |
| InChI Key: | KMDRYNRNHKTIOA-UHFFFAOYSA-N |