AC1N9ROR
ethyl 4-[3-[(4-bromo-2-chlorophenoxy)methyl]-4-methoxyphenyl]-2-methyl-5-oxo-4,6,7,8-tetrahydro-1H-quinoline-3-carboxylate
Also Known As: AK-968/41024465|ethyl 4-{3-[(4-bromo-2-chlorophenoxy)methyl]-4-methoxyphenyl}-2-methyl-5-oxo-1,4,5,6,7,8-hexahydro-3-quinolinecarboxylate|ethyl 4-[3-[(4-bromo-2-chlorophenoxy)methyl]-4-methoxyphenyl]-2-methyl-5-oxo-4,6,7,8-tetrahydro-1H-quinoline-3-carboxylate|ethyl 4-(3-((4-bromo-2-chlorophenoxy)methyl)-4-methoxyphenyl)-2-methyl-5-oxo-1,4,5,6,7,8-hexahydroquinoline-3-carboxylate|ethyl 4-{3-[(4-bromo-2-chlorophenoxy)methyl]-4-methoxyphenyl}-2-methyl-5-oxo-1,4,5,6,7,8-hexahydroquinoline-3-carboxylate
| Molecular Formula | C27H27BrClNO5 |
|---|---|
| Molecular Weight | 559.0761 g/mol |
| LogP | 6.2211 |
| Topological Polar Surface Area | 73.86 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 6 |
| Rotatable Bonds | 7 |
| Exact Mass | 559.0761 |
| Monoisotopic Mass | 559.0761 |
| Heavy Atoms | 35 |
| Complexity | 1236.0726 |
Chemical Identifiers
| CAS Number | 445236-84-0 |
|---|---|
| SMILES | CCOC(=O)C1=C(NC2=C(C1C3=CC(=C(C=C3)OC)COC4=C(C=C(C=C4)Br)Cl)C(=O)CCC2)C |
Product Overview
AC1N9ROR (CAS 445236-84-0), with molecular formula C27H27BrClNO5 and molecular weight 559.0761 g/mol. IUPAC: ethyl 4-[3-[(4-bromo-2-chlorophenoxy)methyl]-4-methoxyphenyl]-2-methyl-5-oxo-4,6,7,8-tetrahydro-1H-quinoline-3-carboxylate.
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