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Ecenofloxacin HCl

CAT: 0013-GTR19240855-01Size: 10 mgDry Ice: NoHazardous: No
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CAT#:0013-GTR19240855-01Size:10 mg
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Description
Ecenofloxacin HCl is the hydrochloride salt of a novel fluorofloxacin antibiotic. It demonstrates potent in vitro antibacterial activity against a broad spectrum of Gram-positive, Gram-negative, and anaerobic bacteria, supporting research in infectious disease and antimicrobial development.
CAS Number
162424-67-1
Smiles
O=C1C=2C (N (C=C1C (O) =O) C3CC3) =NC (=C (F) C2) N4C[C@]5 (C) [C@] (C4) ([C@H] (N) C5) [H].Cl
Molecular Formula
C19H22ClFN4O3
Molecular Weight
408.85
Storage Conditions
-20°C
Notes
For research use only.

Chemical Information

Cfc-222
CAS Number162424-67-1
PubChem CID178065
IUPAC Name7-[(1R,5S,6S)-6-amino-1-methyl-3-azabicyclo[3.2.0]heptan-3-yl]-1-cyclopropyl-6-fluoro-4-oxo-1,8-naphthyridine-3-carboxylic acid;hydrochloride
Molecular FormulaC19H22ClFN4O3
Molecular Weight408.9
Topological Polar Surface Area99.8
Hydrogen Bond Donor Count3
Hydrogen Bond Acceptor Count8
Rotatable Bond Count3
Heavy Atom Count28
Formal Charge0
Complexity726
SMILES
C[C@@]12C[C@@H]([C@@H]1CN(C2)C3=C(C=C4C(=O)C(=CN(C4=N3)C5CC5)C(=O)O)F)N.Cl
InChI
InChI=1S/C19H21FN4O3.ClH/c1-19-5-14(21)12(19)7-23(8-19)17-13(20)4-10-15(25)11(18(26)27)6-24(9-2-3-9)16(10)22-17;/h4,6,9,12,14H,2-3,5,7-8,21H2,1H3,(H,26,27);1H/t12-,14-,19-;/m0./s1
InChIKey
OTJVJUVCWOCNQA-ZJKXRWPCSA-N
Chemical Structure
2D Structure
2D structure of Cfc-222
CAS: 162424-67-1
CID: 178065
Formula: C19H22ClFN4O3
MW: 408.9
Interactive 3D Structure
Loading 3D structure...
View on PubChemRaw 3D data
Computed Properties
PropertyValue
Molecular Weight408.9
Hydrogen Bond Donor Count3
Hydrogen Bond Acceptor Count8
Rotatable Bond Count3
Exact Mass408.1364464
Monoisotopic Mass408.1364464
Topological Polar Surface Area99.8 Ų
Heavy Atom Count28
Formal Charge0
Complexity726
Isotope Atom Count0
Defined Atom Stereocenter Count3
Undefined Atom Stereocenter Count0
Defined Bond Stereocenter Count0
Undefined Bond Stereocenter Count0
Covalently-Bonded Unit Count2
Compound Is CanonicalizedYes

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