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Cletoquine-[d4]

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Category Influenza Virus
CAS 1216461-56-1
Description Cletoquine-[d4] is the labelled impurity of Hydroxychloroquine. Hydroxychloroquine is a medication used to prevent and treat malaria in areas where malaria remains sensitive to chloroquine.
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Product Information

Synonyms 2-((4-((7-Chloroquinolin-4-yl)amino)pentyl-1,1,2,2-d4)amino)ethan-1-ol; Cletoquine-d4; 2-[[4-[(7-Chloro-4-quinolinyl)amino]pentyl-1,1,2,2-d4]amino]ethanol; Desethyl Hydroxy Chloroquine-d4; Cletoquine D4; Desethyl Hydroxychloroquine-d4; Cletoquine-d4-1; 2-[[4-[(7-Chloro-4-quinolyl)amino]pentyl]amino]ethanol-d4; (+/-)-Desethylhydroxychloroquine-d4; Desethylhydroxychloroquine-d4
IUPAC Name 2-[[4-[(7-chloroquinolin-4-yl)amino]-1,1,2,2-tetradeuteriopentyl]amino]ethanol
Molecular Weight 311.84
Molecular Formula C16H18D4ClN3O
Canonical SMILES [2H]C([2H])(CC(C)NC1=C2C=CC(=CC2=NC=C1)Cl)C([2H])([2H])NCCO
InChI InChI=1S/C16H22ClN3O/c1-12(3-2-7-18-9-10-21)20-15-6-8-19-16-11-13(17)4-5-14(15)16/h4-6,8,11-12,18,21H,2-3,7,9-10H2,1H3,(H,19,20)/i2D2,7D2
InChIKey XFICNUNWUREFDP-BRVWLQDISA-N
Purity >95%
Solubility In vitro:
10 mM in DMSO
Appearance Solid powder
Storage Store at 2-8 °C
Complexity 293
Exact Mass 311.1702470
In Vitro Stable heavy isotopes of hydrogen, carbon, and other elements have been incorporated into drug molecules, largely as tracers for quantitation during the drug development process. Deuteration has gained attention because of its potential to affect the pharmacokinetic and Metabolic profiles of drugs.
PSA 131.78000
Target Influenza Virus; Parasite
XLogP3-AA 2.7

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