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Sulfaquinoxaline-d4

CAT: 0804-HY-B1282S-01Size: 1 mgDry Ice: NoHazardous: No
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CAT#:0804-HY-B1282S-01Size:1 mg
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24/48H Stock Items & 2 to 6 Weeks non Stock Items.
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Description
Sulfaquinoxaline-d4 is the deuterium labeled Sulfaquinoxaline. Sulfaquinoxaline is an antimicrobial for veterinary use, with activity against a broad spectrum of Gram-negative and Gram-positive bacteria. Sulfaquinoxaline is used to prevent coccidiosis and bacterial infections[1][2].
CAS Number
1329652-02-9
UNSPSC
12352005
Target
Antibiotic; Bacterial; Isotope-Labeled Compounds; Parasite
Type
Isotope-Labeled Compounds
Related Pathways
Anti-infection; Others
Field of Research
Infection
Solubility
10 mM in DMSO
Smiles
O=S(C1=C([2H])C([2H])=C(N)C([2H])=C1[2H])(NC2=NC3=CC=CC=C3N=C2)=O
Molecular Formula
C14H8D4N4O2S
Molecular Weight
304.36
References & Citations
[1]Russak EM, et al. Impact of Deuterium Substitution on the Pharmacokinetics of Pharmaceuticals. Ann Pharmacother. 2019;53 (2) :211-216. |[2]de Assis DC, et al. Evaluation of the Presence and Levels of Enrofloxacin, Ciprofloxacin, Sulfaquinoxaline and Oxytetracycline in Broiler Chickens after Drug Administration. PLoS One. 2016 Nov 15;11 (11) :e0166402.; Urbano VR, et al. Influence of pH and ozone dose on sulfaquinoxaline ozonation. J Environ Manage. 2017 Jun 15;195 (Pt 2) :224-231.
Shipping Conditions
Room temperature
Scientific Category
Isotope-Labeled Compounds
Clinical Information
No Development Reported
Isoform
Coccidia

Chemical Information

Sulfaquinoxaline-d4
CAS Number1329652-02-9
PubChem CID71752254
IUPAC Name4-amino-2,3,5,6-tetradeuterio-N-quinoxalin-2-ylbenzenesulfonamide
Molecular FormulaC14H12N4O2S
Molecular Weight304.36
XLogP1.7
Topological Polar Surface Area106
Hydrogen Bond Donor Count2
Hydrogen Bond Acceptor Count6
Rotatable Bond Count3
Heavy Atom Count21
Formal Charge0
Complexity442
SMILES
[2H]C1=C(C(=C(C(=C1N)[2H])[2H])S(=O)(=O)NC2=NC3=CC=CC=C3N=C2)[2H]
InChI
InChI=1S/C14H12N4O2S/c15-10-5-7-11(8-6-10)21(19,20)18-14-9-16-12-3-1-2-4-13(12)17-14/h1-9H,15H2,(H,17,18)/i5D,6D,7D,8D
InChIKey
NHZLNPMOSADWGC-KDWZCNHSSA-N
Chemical Structure
2D Structure
2D structure of Sulfaquinoxaline-d4
CAS: 1329652-02-9
CID: 71752254
Formula: C14H12N4O2S
MW: 304.36
Interactive 3D Structure
Loading 3D structure...
View on PubChemRaw 3D data
Computed Properties
PropertyValue
Molecular Weight304.36
XLogP31.7
Hydrogen Bond Donor Count2
Hydrogen Bond Acceptor Count6
Rotatable Bond Count3
Exact Mass304.09320380
Monoisotopic Mass304.09320380
Topological Polar Surface Area106 Ų
Heavy Atom Count21
Formal Charge0
Complexity442
Isotope Atom Count4
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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