Triclabendazole sulfone

Base Information

• Chemical Name: Triclabendazole sulfone
• CAS No.: 106791-37-1
• Molecular Formula: C14H9 Cl3 N2 O3 S
• Molecular Weight: 391.662
• UNII: D7KM923JRE
• DSSTox Substance ID: DTXSID60438406
• Wikidata: Q82254145
• Mol file: 106791-37-1.mol

Synonyms:Triclabendazole sulfone;106791-37-1;5-chloro-6-(2,3-dichlorophenoxy)-2-(methylsulfonyl)-1H-benzo[d]imidazole;Triclabendazole-sulfone;6-chloro-5-(2,3-dichlorophenoxy)-2-methylsulfonyl-1H-benzimidazole;D7KM923JRE;Triclabendazole metabolite M9;CGA274204;CGA-110753;6-Chloro-5-(2,3-dichlorophenoxy)-2-(methylsulfonyl)-1H-benzimidazole;1H-Benzimidazole, 6-chloro-5-(2,3-dichlorophenoxy)-2-(methylsulfonyl)-;1H-Benzimidazole, 5-chloro-6-(2,3-dichlorophenoxy)-2-(methylsulfonyl)- (9CI);CGA 110753;Triclabendazole Sulfone;UNII-D7KM923JRE;C14H9Cl3N2O3S;DTXSID60438406;5-Chloro-6-(2,3-dichlorophenoxy)-2-(methylsulfonyl)-1H-benzimidazole;1ST5582;5-chloro-6-(2,3-dichlorophenoxy)-2-methanesulfonyl-1H-1,3-benzodiazole

Chemical Property of Triclabendazole sulfone

Chemical Property:

• Melting Point: approximate 197℃ (dec.)
• PSA: 80.43000
• LogP: 5.79970
• Storage Temp.: -20°C Freezer
• Solubility.: Methanol (Slightly, Heated)
• XLogP3: 4.5
• Hydrogen Bond Donor Count: 1
• Hydrogen Bond Acceptor Count: 4
• Rotatable Bond Count: 3
• Exact Mass: 389.939946
• Heavy Atom Count: 23
• Complexity: 530

Purity/Quality:

98%Min ^*data from raw suppliers

Triclabendazole sulfone ^*data from reagent suppliers

Safty Information:

• Pictogram(s):  
• Hazard Codes: 

MSDS Files:

SDS file from LookChem

Useful:

• Canonical SMILES: CS(=O)(=O)C1=NC2=CC(=C(C=C2N1)Cl)OC3=C(C(=CC=C3)Cl)Cl
• Uses: Triclabendazole Sulfone is a metabolite of Triclabendazole (T774175), the only anthelmintic drug, which is active against immature, mature and adult stages of fluke.