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Sparfloxacin

CAT: 0024-sc-202343CSize: 100 gDry Ice: NoHazardous: No
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CAT#:0024-sc-202343CSize:100 g
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CAS Number
110871-86-8

Chemical Information

Sparfloxacin

Sparfloxacin is a quinolone, a quinolinemonocarboxylic acid, a N-arylpiperazine, a quinolone antibiotic and a fluoroquinolone antibiotic.

CAS Number110871-86-8
PubChem CID60464
IUPAC Name5-amino-1-cyclopropyl-7-[(3R,5S)-3,5-dimethylpiperazin-1-yl]-6,8-difluoro-4-oxoquinoline-3-carboxylic acid
Molecular FormulaC19H22F2N4O3
Molecular Weight392.4
XLogP0.1
Topological Polar Surface Area98.9
Hydrogen Bond Donor Count3
Hydrogen Bond Acceptor Count9
Rotatable Bond Count3
Heavy Atom Count28
Formal Charge0
Complexity691
SMILES
C[C@@H]1CN(C[C@@H](N1)C)C2=C(C(=C3C(=C2F)N(C=C(C3=O)C(=O)O)C4CC4)N)F
InChI
InChI=1S/C19H22F2N4O3/c1-8-5-24(6-9(2)23-8)17-13(20)15(22)12-16(14(17)21)25(10-3-4-10)7-11(18(12)26)19(27)28/h7-10,23H,3-6,22H2,1-2H3,(H,27,28)/t8-,9+
InChIKey
DZZWHBIBMUVIIW-DTORHVGOSA-N
Chemical Structure
2D Structure
2D structure of Sparfloxacin
CAS: 110871-86-8
CID: 60464
Formula: C19H22F2N4O3
MW: 392.4
Interactive 3D Structure
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View on PubChemRaw 3D data
Computed Properties
PropertyValue
Molecular Weight392.4
XLogP30.1
Hydrogen Bond Donor Count3
Hydrogen Bond Acceptor Count9
Rotatable Bond Count3
Exact Mass392.16599690
Monoisotopic Mass392.16599690
Topological Polar Surface Area98.9 Ų
Heavy Atom Count28
Formal Charge0
Complexity691
Isotope Atom Count0
Defined Atom Stereocenter Count2
Undefined Atom Stereocenter Count0
Defined Bond Stereocenter Count0
Undefined Bond Stereocenter Count0
Covalently-Bonded Unit Count1
Compound Is CanonicalizedYes

Alternative Products

CatalogName
C39SD1157Sparfloxacin

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