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Home Sulfos Toltrazuril sulfone

Toltrazuril sulfone

CAS No.:
69004-04-2
Catalog Number:
AG005M6C
Molecular Formula:
C18H14F3N3O6S
Molecular Weight:
457.3805
Pack Size
Purity
Availability
Location
Price(USD)
Quantity
  
25mg
95%
In Stock USA
United States
$115
- +
100mg
95%
In Stock USA
United States
$155
- +
1g
95%
In Stock USA
United States
$433
- +
Product Description
Catalog Number:
AG005M6C
Chemical Name:
Toltrazuril sulfone
CAS Number:
69004-04-2
Molecular Formula:
C18H14F3N3O6S
Molecular Weight:
457.3805
MDL Number:
MFCD09263475
IUPAC Name:
1-methyl-3-[3-methyl-4-[4-(trifluoromethylsulfonyl)phenoxy]phenyl]-1,3,5-triazinane-2,4,6-trione
InChI:
InChI=1S/C18H14F3N3O6S/c1-10-9-11(24-16(26)22-15(25)23(2)17(24)27)3-8-14(10)30-12-4-6-13(7-5-12)31(28,29)18(19,20)21/h3-9H,1-2H3,(H,22,25,26)
InChI Key:
VBUNOIXRZNJNAD-UHFFFAOYSA-N
SMILES:
Cc1cc(ccc1Oc1ccc(cc1)S(=O)(=O)C(F)(F)F)n1c(=O)[nH]c(=O)n(c1=O)C
UNII:
JPW84AS66U
Properties
Complexity:
836  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
457.056g/mol
Formal Charge:
0
Heavy Atom Count:
31  
Hydrogen Bond Acceptor Count:
9  
Hydrogen Bond Donor Count:
1  
Isotope Atom Count:
0
Molecular Weight:
457.38g/mol
Monoisotopic Mass:
457.056g/mol
Rotatable Bond Count:
4  
Topological Polar Surface Area:
122A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
3.1  
Literature
Title Journal
Toltrazuril sulfone sodium salt: synthesis, analytical detection, and pharmacokinetics in the horse. Journal of veterinary pharmacology and therapeutics 20120601
Keratoconjunctivitis associated with Toxoplasma gondii in a dog. Veterinary ophthalmology 20090101
Equine protozoal myeloencephalitis associated with neosporosis in 3 horses. Journal of veterinary internal medicine 20070101
Ponazuril inhibits the development of Eimeria vermiformis in experimentally infected outbred Swiss mice. Parasitology research 20050201
Effects of toltrazuril and ponazuril on Hammondia heydorni (syn. Neospora caninum) infections in mice. Parasitology research 20040401
Effects of toltrazuril and ponazuril on the fine structure and multiplication of tachyzoites of the NC-1 strain of Neospora caninum (a synonym of Hammondia heydorni) in cell cultures. Parasitology research 20040401
The production and characterisation of an antibody to detect the coccidiostat toltrazuril and its metabolite ponazuril. The Analyst 20030501
Efficacy of toltrazuril and ponazuril against experimental Neospora caninum infection in mice. Parasitology research 20010101
Safety of ponazuril 15% oral paste in horses. Veterinary therapeutics : research in applied veterinary medicine 20010101
Properties