ethyl 4-(2-bromo-4-methylanilino)-7-chloro-6-methoxyquinoline-3-carboxylate
Chemical Structure Depiction of
ethyl 4-(2-bromo-4-methylanilino)-7-chloro-6-methoxyquinoline-3-carboxylate
ethyl 4-(2-bromo-4-methylanilino)-7-chloro-6-methoxyquinoline-3-carboxylate
Compound characteristics
| Compound ID: | C053-0703 |
| Compound Name: | ethyl 4-(2-bromo-4-methylanilino)-7-chloro-6-methoxyquinoline-3-carboxylate |
| Molecular Weight: | 449.73 |
| Molecular Formula: | C20 H18 Br Cl N2 O3 |
| Smiles: | CCOC(c1cnc2cc(c(cc2c1Nc1ccc(C)cc1[Br])OC)[Cl])=O |
| Stereo: | ACHIRAL |
| logP: | 5.9458 |
| logD: | 5.9449 |
| logSw: | -6.0385 |
| Hydrogen bond acceptors count: | 5 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 44.294 |
| InChI Key: | MRRBCNGMCGGJEB-UHFFFAOYSA-N |