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Quindoxin

CAT: 0013-GTR19264777-04Size: 25 mgDry Ice: NoHazardous: No
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CAT#:0013-GTR19264777-04Size:25 mg
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Description
Quindoxin is a potent antibacterial agent that has been rigorously evaluated for genetic toxicity using the Salmonella microsomal assay system, where experimental testing demonstrated that this compound induces both base pair substitution mutations and frameshift mutations in Salmonella strains independently of the presence of a rat liver microsomal fraction, with mutagenic activity shown to be mechanistically dependent on the presence of its N-oxide functional group, as fully reduced quinoxaline lacked mutagenicity while partially reduced quinoxaline-N-oxide displayed diminished activity, and recA- and uvrB-deficient Salmonella strains exhibited increased susceptibility compared with wild-type strains.
CAS Number
2423-66-7
Purity
95.00% (May vary between batches)
Smiles
O=N=1C=CN (=O) =C2C=CC=CC21
Molecular Formula
C8H6N2O2
Molecular Weight
162.15
Storage Conditions
-20°C
Notes
For research use only.

Chemical Information

Quindoxin

Quindoxin is a quinoxaline derivative.

CAS Number2423-66-7
PubChem CID72073
IUPAC Name4-oxidoquinoxalin-1-ium 1-oxide
Molecular FormulaC8H6N2O2
Molecular Weight162.15
XLogP-0.1
Topological Polar Surface Area46.4
Hydrogen Bond Donor Count0
Hydrogen Bond Acceptor Count3
Rotatable Bond Count0
Heavy Atom Count12
Formal Charge0
Complexity206
SMILES
C1=CC=C2C(=C1)N(C=C[N+]2=O)[O-]
InChI
InChI=1S/C8H6N2O2/c11-9-5-6-10(12)8-4-2-1-3-7(8)9/h1-6H
InChIKey
CKIHZSGJPSDCNC-UHFFFAOYSA-N
Chemical Structure
2D Structure
2D structure of Quindoxin
CAS: 2423-66-7
CID: 72073
Formula: C8H6N2O2
MW: 162.15
Interactive 3D Structure
Loading 3D structure...
View on PubChemRaw 3D data
Computed Properties
PropertyValue
Molecular Weight162.15
XLogP3-0.1
Hydrogen Bond Donor Count0
Hydrogen Bond Acceptor Count3
Rotatable Bond Count0
Exact Mass162.042927438
Monoisotopic Mass162.042927438
Topological Polar Surface Area46.4 Ų
Heavy Atom Count12
Formal Charge0
Complexity206
Isotope Atom Count0
Defined Atom Stereocenter Count0
Undefined Atom Stereocenter Count0
Defined Bond Stereocenter Count0
Undefined Bond Stereocenter Count0
Covalently-Bonded Unit Count1
Compound Is CanonicalizedYes

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CatalogName
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