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Didesethyl Chloroquine-[d4]

General Information
Catalog: BLP-012827
CAS: 1215797-41-3
Molecular Formula: C14H14D4ClN3
Molecular Weight: 267.79
Chemical Structure
Didesethyl Chloroquine-[d4]
Description Didesethyl Chloroquine-[d4] is the labelled analogue of Didesethyl Chloroquine, which is a metabolite of Chloroquine. Chloroquine is used for the therapy and prevention of malaria.
Synonyms Didesethyl Chloroquine D4; N4-(7-Chloro-4-quinolinyl)-1,4-pentanediamine-d4; 4-[(4-Amino-1-methylbutyl)amino]-7-chloroquinoline-d4; Bisdeethylchloroquine-d4; Bisdesethylchloroquine-d4; N,N-Dideethylchloroquine-d4
IUPAC Name 4-N-(7-chloroquinolin-4-yl)-1,1,2,2-tetradeuteriopentane-1,4-diamine
Related CAS 4298-14-0 (unlabelled)
Isomeric SMILES [2H]C([2H])(CC(C)NC1=C2C=CC(=CC2=NC=C1)Cl)C([2H])([2H])N
Canonical SMILES CC(CCCN)NC1=C2C=CC(=CC2=NC=C1)Cl
InChI InChI=1S/C14H18ClN3/c1-10(3-2-7-16)18-13-6-8-17-14-9-11(15)4-5-12(13)14/h4-6,8-10H,2-3,7,16H2,1H3,(H,17,18)/i2D2,7D2
InChI Key GYEDIFVVTRKXHP-BRVWLQDISA-N
Melting Point 139-140°C
Purity 98%; ≥98% atom D
Solubility Soluble in Chloroform (Slightly, Heated), Methanol (Slightly)
Appearance Pale Yellow Solid
Storage Store at -20°C

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