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CAS 949465-91-2

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Ethyl 6-[(3-chloro-2-fluorophenyl)methyl]-1,4-dihydro-1-[(1S)-1-(hydroxymethyl)-2-methylpropyl]-7-methoxy-4-oxo-3-quinolinecarboxylate

Description:
Ethyl 6-[(3-chloro-2-fluorophenyl)methyl]-1,4-dihydro-1-[(1S)-1-(hydroxymethyl)-2-methylpropyl]-7-methoxy-4-oxo-3-quinolinecarboxylate, with CAS number 949465-91-2, is a synthetic organic compound characterized by its complex structure, which includes a quinoline core. This compound features multiple functional groups, including an ethyl ester, a methoxy group, and a hydroxymethyl substituent, contributing to its potential biological activity. The presence of halogen atoms, specifically chlorine and fluorine, may influence its pharmacological properties and interactions with biological targets. The dihydroquinoline structure suggests potential applications in medicinal chemistry, particularly in the development of pharmaceuticals. Its specific stereochemistry, indicated by the (1S) configuration, is crucial for its biological activity and efficacy. Overall, this compound represents a class of quinoline derivatives that may exhibit diverse therapeutic effects, warranting further investigation into its chemical behavior and potential applications in drug development.
Formula:C25H27ClFNO5
InChI:InChI=1S/C25H27ClFNO5/c1-5-33-25(31)18-12-28(21(13-29)14(2)3)20-11-22(32-4)16(10-17(20)24(18)30)9-15-7-6-8-19(26)23(15)27/h6-8,10-12,14,21,29H,5,9,13H2,1-4H3/t21-/m1/s1
InChI key:InChIKey=GGYDRMLFDVOKBX-OAQYLSRUSA-N
SMILES:[C@H](C(C)C)(CO)N1C=2C(=CC(CC3=C(F)C(Cl)=CC=C3)=C(OC)C2)C(=O)C(C(OCC)=O)=C1
Synonyms:
  • 3-Quinolinecarboxylic acid 6-[(3-chloro-2-fluorophenyl)methyl]-1,4-dihydro-1-[(1S)-1-(hydroxymethyl)-2-methylpropyl]-7-methoxy-4-oxo-, ethyl ester
  • 3-Quinolinecarboxylic acid, 6-[(3-chloro-2-fluorophenyl)methyl]-1,4-dihydro-1-[(1S)-1-(hydroxymethyl)-2-methylpropyl]-7-methoxy-4-oxo-, ethyl ester
  • Ethyl 6-[(3-chloro-2-fluorophenyl)methyl]-1,4-dihydro-1-[(1S)-1-(hydroxymethyl)-2-methylpropyl]-7-methoxy-4-oxo-3-quinolinecarboxylate
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