6-Fluoro-1-(4-fluorophenyl)-7-(4-methyl-1-piperazinyl)-4-oxo-1,4-dihydro-3-quinolinecarboxylic acid | CAS No. 98106-17-3

6-Fluoro-1-(4-fluorophenyl)-7-(4-methyl-1-piperazinyl)-4-oxo-1,4-dihydro-3-quinolinecarboxylic acid

Basic Information

CAS Number

98106-17-3

Molecular Formula

C21H19F2N3O3

Molecular Weight

399.4 g/mol

AD

Basic Physical Properties

Boiling Point

595.5°C at 760 mmHg

CN1CCN(CC1)C2=C(C=C3C(=C2)N(C=C(C3=O)C(=O)O)C4=CC=C(C=C4)F)F

InChI

InChI=1S/C21H19F2N3O3/c1-24-6-8-25(9-7-24)19-11-18-15(10-17(19)23)20(27)16(21(28)29)12-26(18)14-4-2-13(22)3-5-14/h2-5,10-12H,6-9H2,1H3,(H,28,29)

InChIKey

NOCJXYPHIIZEHN-UHFFFAOYSA-N

LogP

2.7189000000000005

Topological Polar Surface Area

65.78 Ų

Hydrogen Bond Donor/Acceptor

1 / 6

Complexity

672

Safety Information

View Safety Information

Hazard Statement

H302 Harmful if swallowed
Acute toxicity, oral
H315 Causes skin irritation
Skin corrosion/irritation
H319 Causes serious eye irritation
Serious eye damage/eye irritation
H335 May cause respiratory irritation
Specific target organ toxicity, single exposure; Respiratory tract irritation

Synonyms & References

English

  • ZINC04099034
  • 5Z7OO9FNFD
  • 6-Fluoro-1-(4-fluorophenyl)-7-(4-methyl-1-piperazinyl)-4-oxo-1,4-dihydro-3-quinolinecarboxylic acid
  • A-56619
  • 98106-17-3
  • 3-QUINOLINECARBOXYLIC ACID, 6-FLUORO-1-(4-FLUOROPHENYL) 1,4-DIHYDRO-7-(4-METHYL-1-PIPERAZINYL)-4-OXO-
  • Difloxacin
  • 6-fluoro-1-(4-fluorophenyl)-7-(4-methylpiperazin-1-yl)-4-oxo-quinoline-3-carboxylic acid
  • HY-121272
  • BCP33408
  • AB00923781_02
  • Dicural
  • 3-Quinolinecarboxylic acid, 6-fluoro-1-(4-fluorophenyl)-1,4-dihydro-7-(4-methyl-1-piperazinyl)-4-oxo-
  • 3-Quinolinecarboxylic acid,6-fluoro-1-(4-fluorophenyl)-1,4-dihydro-7-(4-methyl-1-piperazinyl)-4-oxo-
  • UNII-5Z7OO9FNFD
  • A858583
  • 6-fluoro-1-(4-fluorophenyl)-7-(4-methylpiperazin-1-yl)-4-oxoquinoline-3-carboxylic acid
  • 6-fluoranyl-1-(4-fluorophenyl)-7-(4-methylpiperazin-1-yl)-4-oxidanylidene-quinoline-3-carboxylic acid
  • 6-FLUORO-1-(P-FLUOROPHENYL)-1,4-DIHYDRO-7-(4-METHYL-1-PIPERAZINYL)-4-OXO-3-QUINOLINECARBOXYLIC ACID
  • 6-fluoro-1-(4-fluorophenyl)-7-(4-methyl-1-piperazinyl)-4-oxo-3-quinolinecarboxylic acid
  • 6-fluoro-1-(4-fluorophenyl)-7-(4-methylpiperazin-1-yl)-4-oxo-quinoline-3-carboxylic acid;Difluoxacin Hydrochloride
  • Q5275450
  • GTPL10801
  • LS-14845
  • FT-0624916
  • AC-12060
  • A845811
  • AB00923781_04
  • NOCJXYPHIIZEHN-UHFFFAOYSA-N
  • SCHEMBL148765
  • CHEMBL6259

MDL Number

MFCD00865975

Customs Code

2933990090

FAQ

What are the physical and chemical properties of 6-Fluoro-1-(4-fluorophenyl)-7-(4-methyl-1-piperazinyl)-4-oxo-1,4-dihydro-3-quinolinecarboxylic acid (CAS: 98106-17-3)?

This compound is a crystalline solid with a molecular weight of approximately 403.2 g/mol. It has a low solubility in water but is more soluble in organic solvents like DMSO. The compound is highly reactive towards bases and may undergo hydrolysis under basic conditions. It is also susceptible to photodegradation.

How is 6-Fluoro-1-(4-fluorophenyl)-7-(4-methyl-1-piperazinyl)-4-oxo-1,4-dihydro-3-quinolinecarboxylic acid (CAS: 98106-17-3) typically synthesized?

This compound is synthesized via a multistep process involving the protection of an alcohol, substitution reactions, and desilylation. Key reagents include silyl ethers and fluorinating agents. The final step involves the coupling of the intermediate with a piperazine derivative. The overall yield is moderate, around 50-60%, with good selectivity.

What industries use 6-Fluoro-1-(4-fluorophenyl)-7-(4-methyl-1-piperazinyl)-4-oxo-1,4-dihydro-3-quinolinecarboxylic acid (CAS: 98106-17-3)?

This compound is primarily used in the pharmaceutical industry for the development of new drugs targeting muscarinic receptors. It is also relevant in polymer chemistry for the synthesis of advanced materials and in the sensor technology for detecting specific analytes.

What precautions should be taken when handling 6-Fluoro-1-(4-fluorophenyl)-7-(4-methyl-1-piperazinyl)-4-oxo-1,4-dihydro-3-quinolinecarboxylic acid (CAS: 98106-17-3)?

Handling this compound requires the use of personal protective equipment (PPE) such as gloves, goggles, and lab coats. It should be conducted in a well-ventilated area or fume hood to prevent inhalation risk. Spills should be cleaned up carefully with appropriate absorbents, and the area should be decontaminated. Always consult the Safety Data Sheet (SDS) for detailed procedures and emergency response instructions.

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