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Balofloxacin dihydrate

CAS No.:
151060-21-8
Catalog Number:
AG001N1P
Molecular Formula:
C20H28FN3O6
Molecular Weight:
425.4512
Pack Size
Purity
Availability
Location
Price(USD)
Quantity
  
1g
>98.0%(T)(HPLC)
1 week
United States
$153
- +
5g
>98.0%(T)(HPLC)
1 week
United States
$388
- +
Product Description
Catalog Number:
AG001N1P
Chemical Name:
Balofloxacin dihydrate
CAS Number:
151060-21-8
Molecular Formula:
C20H28FN3O6
Molecular Weight:
425.4512
MDL Number:
MFCD00864925
IUPAC Name:
1-cyclopropyl-6-fluoro-8-methoxy-7-[3-(methylamino)piperidin-1-yl]-4-oxoquinoline-3-carboxylic acid;dihydrate
InChI:
InChI=1S/C20H24FN3O4.2H2O/c1-22-11-4-3-7-23(9-11)17-15(21)8-13-16(19(17)28-2)24(12-5-6-12)10-14(18(13)25)20(26)27;;/h8,10-12,22H,3-7,9H2,1-2H3,(H,26,27);2*1H2
InChI Key:
WEGNYJXOCPJAPS-UHFFFAOYSA-N
SMILES:
CNC1CCCN(C1)c1c(F)cc2c(c1OC)n(cc(c2=O)C(=O)O)C1CC1.O.O
Properties
Complexity:
668  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
3  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
425.196g/mol
Formal Charge:
0
Heavy Atom Count:
30  
Hydrogen Bond Acceptor Count:
10  
Hydrogen Bond Donor Count:
4  
Isotope Atom Count:
0
Molecular Weight:
425.457g/mol
Monoisotopic Mass:
425.196g/mol
Rotatable Bond Count:
5  
Topological Polar Surface Area:
84.1A^2
Undefined Atom Stereocenter Count:
1  
Undefined Bond Stereocenter Count:
0
Literature
Title Journal
Alterations of protein complexes and pathways in genetic information flow and response to stimulus contribute to Escherichia coli resistance to balofloxacin. Molecular bioSystems 20120901
Downregulation of Na(+)-NQR complex is essential for Vibrio alginolyticus in resistance to balofloxacin. Journal of proteomics 20120517
Synthesis and in vitro antimycobacterial activity of balofloxacin ethylene isatin derivatives. European journal of medicinal chemistry 20100801
Gatifloxacin, moxifloxacin, and balofloxacin resistance due to mutations in the gyrA and parC genes of Staphylococcus epidermidis strains isolated from patients with endophthalmitis, corneal ulcers and conjunctivitis. Ophthalmic research 20090101
[Determination of balofloxacin in human plasma by HPLC with solid-phase extraction]. Se pu = Chinese journal of chromatography 20071101
High performance liquid chromatography-electrospray ionization mass spectrometric determination of balofloxacin in human plasma and its pharmacokinetics. Journal of chromatography. B, Analytical technologies in the biomedical and life sciences 20070501
[Studies on the reaction of balofloxacin with bovine serum albumin]. Guang pu xue yu guang pu fen xi = Guang pu 20060801
Electrophysiological safety of novel fluoroquinolone antibiotic agents gemifloxacin and balofloxacin. Drug and chemical toxicology 20060101
[Interaction between balofloxacin and DNA and the influence of Mg2+ on the interaction]. Yao xue xue bao = Acta pharmaceutica Sinica 20050701
Balofloxacin Choongwae. Current opinion in investigational drugs (London, England : 2000) 20030201
[In vitro antimycobacterial activities of a new quinolone, balofloxacin]. Kekkaku : [Tuberculosis] 20010101
[Determination of antimycobacterial activities of fluoroquinolones against clinical isolates of Mycobacterium tuberculosis: comparative determination with egg-based Ogawa and agar-based Middlebrook 7H10 media]. Kekkaku : [Tuberculosis] 19960801
Properties