diethyl 4-(3-bromo-4-methylanilino)quinoline-3,6-dicarboxylate
Chemical Structure Depiction of
diethyl 4-(3-bromo-4-methylanilino)quinoline-3,6-dicarboxylate
diethyl 4-(3-bromo-4-methylanilino)quinoline-3,6-dicarboxylate
Compound characteristics
| Compound ID: | 5596-1322 |
| Compound Name: | diethyl 4-(3-bromo-4-methylanilino)quinoline-3,6-dicarboxylate |
| Molecular Weight: | 457.32 |
| Molecular Formula: | C22 H21 Br N2 O4 |
| Smiles: | CCOC(c1ccc2c(c1)c(c(cn2)C(=O)OCC)Nc1ccc(C)c(c1)[Br])=O |
| Stereo: | ACHIRAL |
| logP: | 5.9396 |
| logD: | 5.9396 |
| logSw: | -5.4624 |
| Hydrogen bond acceptors count: | 7 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 58.115 |
| InChI Key: | IFNSWWMCNCFUKV-UHFFFAOYSA-N |