ethyl 6-bromo-4-{[2-(3,4-dimethoxyphenyl)ethyl]amino}quinoline-3-carboxylate
Chemical Structure Depiction of
ethyl 6-bromo-4-{[2-(3,4-dimethoxyphenyl)ethyl]amino}quinoline-3-carboxylate
ethyl 6-bromo-4-{[2-(3,4-dimethoxyphenyl)ethyl]amino}quinoline-3-carboxylate
Compound characteristics
| Compound ID: | 5977-0115 |
| Compound Name: | ethyl 6-bromo-4-{[2-(3,4-dimethoxyphenyl)ethyl]amino}quinoline-3-carboxylate |
| Molecular Weight: | 459.34 |
| Molecular Formula: | C22 H23 Br N2 O4 |
| Smiles: | CCOC(c1cnc2ccc(cc2c1NCCc1ccc(c(c1)OC)OC)[Br])=O |
| Stereo: | ACHIRAL |
| logP: | 4.1911 |
| logD: | 4.191 |
| logSw: | -4.189 |
| Hydrogen bond acceptors count: | 6 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 53.786 |
| InChI Key: | LYBUSJBVXKPCMZ-UHFFFAOYSA-N |