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N-Acetyl Desethyl Chloroquine-[d4]

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General Information
Catalog: BLP-004868
CAS: 1216619-20-3
Molecular Formula: C18H20D4ClN3O
Molecular Weight: 337.88

Chemical Structure

Description	N-Acetyl Desethyl Chloroquine-[d4] is the labelled analogue of N-Acetyl Desethyl Chloroquine, which is a Chloroquine metabolite and an intermediate for the preparation of Chloroquine.
Synonyms	N-Acetyl Desethyl Chloroquine D4; N-[4-[(7-Chloro-4-quinolinyl)amino]pentyl]-N-ethyl-acetamide-d4; N-Acetyl(mono)desthylchloroquine-d4
IUPAC Name	N-[4-[(7-chloroquinolin-4-yl)amino]-1,1,2,2-tetradeuteriopentyl]-N-ethylacetamide
Related CAS	91828-61-4 (unlabelled)
Canonical SMILES	CCN(CCCC(C)NC1=C2C=CC(=CC2=NC=C1)Cl)C(=O)C
InChI	InChI=1S/C18H24ClN3O/c1-4-22(14(3)23)11-5-6-13(2)21-17-9-10-20-18-12-15(19)7-8-16(17)18/h7-10,12-13H,4-6,11H2,1-3H3,(H,20,21)/i5D2,11D2
InChI Key	HGDLFXICTKRYJP-LHJLJATRSA-N
Melting Point	127-129°C
Purity	≥98%; ≥98% atom D
Solubility	Slightly soluble in Chloroform, DMSO, Methanol
Appearance	Off-white to Pale Yellow Solid
Storage	Store at -20°C under inert atmosphere