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113617-63-3

113617-63-3 | 3-Quinolinecarboxylic acid, 1-cyclopropyl-7-[(3R,5S)-3,5-dimethyl-1-piperazinyl]-5,6,8-trifluoro-1,4-dihydro-4-oxo-, rel-

CAS No: 113617-63-3 Catalog No: AG00096D MDL No:MFCD00864858

Product Description

Catalog Number:
AG00096D
Chemical Name:
3-Quinolinecarboxylic acid, 1-cyclopropyl-7-[(3R,5S)-3,5-dimethyl-1-piperazinyl]-5,6,8-trifluoro-1,4-dihydro-4-oxo-, rel-
CAS Number:
113617-63-3
Molecular Formula:
C19H20F3N3O3
Molecular Weight:
395.3756
MDL Number:
MFCD00864858
IUPAC Name:
1-cyclopropyl-7-[(3R,5S)-3,5-dimethylpiperazin-1-yl]-5,6,8-trifluoro-4-oxoquinoline-3-carboxylic acid
InChI:
InChI=1S/C19H20F3N3O3/c1-8-5-24(6-9(2)23-8)17-14(21)13(20)12-16(15(17)22)25(10-3-4-10)7-11(18(12)26)19(27)28/h7-10,23H,3-6H2,1-2H3,(H,27,28)/t8-,9+
InChI Key:
QIPQASLPWJVQMH-DTORHVGOSA-N
SMILES:
C[C@@H]1N[C@H](C)CN(C1)c1c(F)c(F)c2c(c1F)n(cc(c2=O)C(=O)O)C1CC1
UNII:
660932TPY6
NSC Number:
758614

Properties

Complexity:
691  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
2  
Defined Bond Stereocenter Count:
0
Exact Mass:
395.146g/mol
Formal Charge:
0
Heavy Atom Count:
28  
Hydrogen Bond Acceptor Count:
9  
Hydrogen Bond Donor Count:
2  
Isotope Atom Count:
0
Molecular Weight:
395.382g/mol
Monoisotopic Mass:
395.146g/mol
Rotatable Bond Count:
3  
Topological Polar Surface Area:
72.9A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
0.9  

Literature

Title Journal
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Simultaneous determination of fluoroquinolones in foods of animal origin by a high performance liquid chromatography and a liquid chromatography tandem mass spectrometry with accelerated solvent extraction. Journal of chromatography. B, Analytical technologies in the biomedical and life sciences 20120215
Characterization of Pseudomonas aeruginosa isolates from dogs and cats in Japan: current status of antimicrobial resistance and prevailing resistance mechanisms. Microbiology and immunology 20120201
Mutant prevention concentration and phenotypic and molecular basis of fluoroquinolone resistance in clinical isolates and in vitro-selected mutants of Escherichia coli from dogs. Veterinary microbiology 20120127
Multiclass analysis of 23 veterinary drugs in milk by ultraperformance liquid chromatography-electrospray tandem mass spectrometry. Journal of chromatography. B, Analytical technologies in the biomedical and life sciences 20120115
Post-antibiotic effect of orbifloxacin against Escherichia coli and Pseudomonas aeruginosa isolates from dogs. Acta veterinaria Scandinavica 20120101
Complications from residual adnexal structures following enucleation in three dogs. Journal of the American Veterinary Medical Association 20111215
Comparative pharmacokinetics of orbifloxacin in healthy and Pasteurella multocida infected ducks. British poultry science 20111001
Rapid screening method for quinolone residues in livestock and fishery products using immobilised metal chelate affinity chromatographic clean-up and liquid chromatography-fluorescence detection. Food additives & contaminants. Part A, Chemistry, analysis, control, exposure & risk assessment 20110901
Multidrug-resistant Acinetobacter baumannii in veterinary clinics, Germany. Emerging infectious diseases 20110901
Pharmacokinetic-pharmacodynamic integration of orbifloxacin in Japanese quail (Coturnix japonica) following oral and intravenous administration. Journal of veterinary pharmacology and therapeutics 20110801
Synthesis and activities of naphthalimide azoles as a new type of antibacterial and antifungal agents. Bioorganic & medicinal chemistry letters 20110715
Allometric scaling of orbifloxacin disposition in nine mammal species: a retrospective analysis. The Journal of veterinary medical science 20110601
2010 ACVIM small animal consensus statement on leptospirosis: diagnosis, epidemiology, treatment, and prevention. Journal of veterinary internal medicine 20110101
Short-term synaptic plasticity in the dentate gyrus of monkeys. PloS one 20110101
Antimicrobial use guidelines for treatment of urinary tract disease in dogs and cats: antimicrobial guidelines working group of the international society for companion animal infectious diseases. Veterinary medicine international 20110101
Determination of residual fluoroquinolones in honey by liquid chromatography using metal chelate affinity chromatography. Journal of AOAC International 20110101
Solvent-free microwave-assisted extraction of fluoroquinolones from soil and liquid chromatography-fluorescence determination. Journal of chromatography. A 20101119
Short communication: Fluoroquinolone susceptibility of Staphylococcus aureus strains isolated from caprine clinical mastitis in southeast Spain. Journal of dairy science 20101101
Single-step extraction followed by LC for determination of (fluoro)quinolone drug residues in muscle, eggs, and milk. Journal of separation science 20100401
Rapid determination of fluoroquinolone residues in honey by a microbiological screening method and liquid chromatography. Journal of AOAC International 20100101
Quantitation of fluoroquinolones in honey using tandem mass spectrometry (LC-MS/MS): nested validation with two mass spectrometers. Journal of AOAC International 20100101
Pharmacokinetics and milk distribution characteristics of orbifloxacin following intravenous and intramuscular injection in lactating ewes. Journal of veterinary pharmacology and therapeutics 20090801
Human-to-dog transmission of methicillin-resistant Staphylococcus aureus. Emerging infectious diseases 20090801
Free-radical-induced oxidative and reductive degradation of fluoroquinolone pharmaceuticals: kinetic studies and degradation mechanism. The journal of physical chemistry. A 20090709
Pharmacokinetics and pharmacokinetic/pharmacodynamic integration of orbifloxacin in Korean Hanwoo cattle. Journal of veterinary pharmacology and therapeutics 20090601
Rapid determination of 19 quinolone residues in spiked fish and pig muscle by high-performance liquid chromatography (HPLC) tandem mass spectrometry. Food additives & contaminants. Part A, Chemistry, analysis, control, exposure & risk assessment 20090301
Approaches for application of sub and supercritical fluid extraction for quantification of orbifloxacin from plasma and milk: application to disposition kinetics. Analytica chimica acta 20090105
[Simultaneous determination of 19 quinolone residues in honey using high performance liquid chromatography-tandem mass spectrometry]. Se pu = Chinese journal of chromatography 20090101
Implementation of terbium-sensitized luminescence in sequential-injection analysis for automatic analysis of orbifloxacin. Analytical and bioanalytical chemistry 20081201
Antimicrobial resistance and genetic characterization of fluoroquinolone resistance of Pseudomonas aeruginosa isolated from canine infections. Veterinary microbiology 20080918
Quality by design, part I: application of NIR spectroscopy to monitor tablet manufacturing process. Journal of pharmaceutical sciences 20080901
Quality by design, part II: application of NIR spectroscopy to monitor the coating process for a pharmaceutical sustained release product. Journal of pharmaceutical sciences 20080901
Quality by design, part III: study of curing process of sustained release coated products using NIR spectroscopy. Journal of pharmaceutical sciences 20080901
Drug resistance mechanism of the fish-pathogenic bacterium Lactococcus garvieae. Journal of fish diseases 20080601
Pharmacokinetics and milk penetration of orbifloxacin after intravenous and intramuscular injections to dromedary lactating camels (Camelus dromedaries). Journal of veterinary pharmacology and therapeutics 20080601
Multiresidue determination of quinolones in animal and fishery products by HPLC. Shokuhin eiseigaku zasshi. Journal of the Food Hygienic Society of Japan 20080601
Pharmacokinetic-pharmacodynamic integration of orbifloxacin in rabbits after intravenous, subcutaneous and intramuscular administration. Journal of veterinary pharmacology and therapeutics 20080201
Pharmacokinetics and milk penetration of orbifloxacin after intravenous, subcutaneous, and intramuscular administration to lactating goats. Journal of dairy science 20070901
[Determination of 16 quinolone residues in animal tissues using high performance liquid chromatography coupled with electrospray ionization tandem mass spectrometry]. Se pu = Chinese journal of chromatography 20070701
Lack of inhibitory effects of several fluoroquinolones on cytochrome P-450 3A activities at clinical dosage in dogs. Journal of veterinary pharmacology and therapeutics 20070201
Antimicrobial testing of selected fluoroquinolones against Pseudomonas aeruginosa isolated from canine otitis. Journal of the American Animal Hospital Association 20070101
Efficacy of orbifloxacin tablets for the treatment of superficial and deep pyoderma due to Staphylococcus intermedius infection in dogs. The Canadian veterinary journal = La revue veterinaire canadienne 20061001
The pharmacokinetics of orbifloxacin in the horse following oral and intravenous administration. Journal of veterinary pharmacology and therapeutics 20060601
Microsphere-based protease assays and screening application for lethal factor and factor Xa. Cytometry. Part A : the journal of the International Society for Analytical Cytology 20060501
Comparison of pharmacodynamic and pharmacokinetic indices of efficacy for 5 fluoroquinolones toward pathogens of dogs and cats. Journal of veterinary internal medicine 20060101
Inhibitory effect of several fluoroquinolones on hepatic microsomal cytochrome P-450 1A activities in dogs. Journal of veterinary pharmacology and therapeutics 20051201
Hepatocellular toxicosis associated with the alternate administration of carprofen and meloxicam in a siberian husky. The Journal of veterinary medical science 20051001
Multiresidue determination of fluoroquinolones in shrimp by liquid chromatography-fluorescence-mass spectrometry. Journal of AOAC International 20050101
Modulation of cellular immune response by orbifloxacin in noninfected and E. coli-infected mice. Immunopharmacology and immunotoxicology 20050101
In vitro antimicrobial activity of orbifloxacin against Staphylococcus intermedius isolates from canine skin and ear infections. Research in veterinary science 20040801
Determination of quinolones and fluoroquinolones in fish tissue and seafood by high-performance liquid chromatography with electrospray ionisation tandem mass spectrometric detection. Journal of chromatography. A 20021220
Multiresidue analysis of fluoroquinolone antibiotics in chicken tissue using liquid chromatography-fluorescence-multiple mass spectrometry. Journal of chromatography. B, Analytical technologies in the biomedical and life sciences 20021115
Comparative serum pharmacokinetics of the fluoroquinolones enrofloxacin, difloxacin, marbofloxacin, and orbifloxacin in dogs after single oral administration. Journal of veterinary pharmacology and therapeutics 20020201
Determination of plasma and skin concentrations of orbifloxacin in dogs with clinically normal skin and dogs with pyoderma. Veterinary therapeutics : research in applied veterinary medicine 20020101
Pharmacokinetics of orbifloxacin and its concentration in body fluids and in endometrial tissues of mares. Canadian journal of veterinary research = Revue canadienne de recherche veterinaire 20010701

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