AC1ME3WL
2-methoxyethyl 4-(3-bromo-4-hydroxy-5-methoxyphenyl)-2-methyl-5-oxo-4,6,7,8-tetrahydro-1H-quinoline-3-carboxylate
Also Known As: BAS 00410704|AB00086201-01|AG-690/10376059|2-methoxyethyl 4-(3-bromo-4-hydroxy-5-methoxyphenyl)-2-methyl-5-oxo-1,4,5,6,7,8-hexahydroquinoline-3-carboxylate|SR-01000407464-1|2-methoxyethyl 4-(3-bromo-4-hydroxy-5-methoxyphenyl)-2-methyl-5-oxo-4,6,7,8-tetrahydro-1H-quinoline-3-carboxylate|2-(methyloxy)ethyl 4-[3-bromo-4-hydroxy-5-(methyloxy)phenyl]-2-methyl-5-oxo-1,4,5,6,7,8-hexahydroquinoline-3-carboxylate|2-methoxyethyl 4-(3-bromo-4-hydroxy-5-methoxyphenyl)-2-methyl-5-oxo-1,4,6,7,8- pentahydroquinoline-3-carboxylate
| Molecular Formula | C21H24BrNO6 |
|---|---|
| Molecular Weight | 465.0787 g/mol |
| LogP | 3.3208 |
| Topological Polar Surface Area | 94.09 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 7 |
| Rotatable Bonds | 6 |
| Exact Mass | 465.0787 |
| Monoisotopic Mass | 465.0787 |
| Heavy Atoms | 29 |
| Complexity | 904.67755 |
Chemical Identifiers
| CAS Number | 5472-58-2 |
|---|---|
| SMILES | CC1=C(C(C2=C(N1)CCCC2=O)C3=CC(=C(C(=C3)Br)O)OC)C(=O)OCCOC |
Product Overview
AC1ME3WL (CAS 5472-58-2), with molecular formula C21H24BrNO6 and molecular weight 465.0787 g/mol. IUPAC: 2-methoxyethyl 4-(3-bromo-4-hydroxy-5-methoxyphenyl)-2-methyl-5-oxo-4,6,7,8-tetrahydro-1H-quinoline-3-carboxylate.