2-phenoxyethyl 4-(5-bromo-2-methoxyphenyl)-2-methyl-5-oxo-1,4,5,6,7,8-hexahydroquinoline-3-carboxylate
Chemical Structure Depiction of
2-phenoxyethyl 4-(5-bromo-2-methoxyphenyl)-2-methyl-5-oxo-1,4,5,6,7,8-hexahydroquinoline-3-carboxylate
2-phenoxyethyl 4-(5-bromo-2-methoxyphenyl)-2-methyl-5-oxo-1,4,5,6,7,8-hexahydroquinoline-3-carboxylate
Compound characteristics
| Compound ID: | 8011-8780 |
| Compound Name: | 2-phenoxyethyl 4-(5-bromo-2-methoxyphenyl)-2-methyl-5-oxo-1,4,5,6,7,8-hexahydroquinoline-3-carboxylate |
| Molecular Weight: | 512.4 |
| Molecular Formula: | C26 H26 Br N O5 |
| Smiles: | CC1=C(C(C2=C(CCCC2=O)N1)c1cc(ccc1OC)[Br])C(=O)OCCOc1ccccc1 |
| Stereo: | RACEMIC MIXTURE |
| logP: | 5.292 |
| logD: | 1.3962 |
| logSw: | -5.2902 |
| Hydrogen bond acceptors count: | 7 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 59.746 |
| InChI Key: | VVKSDFUYTNGRBC-DEOSSOPVSA-N |