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N-Desbutyldronedarone-[d6] hydrochloride

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General Information
Catalog: BLP-013057
CAS: 1346598-70-6
Molecular Formula: C27H30D6N2O5S.HCl
Molecular Weight: 543.15

Chemical Structure

Description	N-Desbutyldronedarone-[d6] hydrochloride is the labelled analogue of N-Desbutyldronedarone hydrochloride, which is a metabolite of Dronedarone. Dronedarone is a medication used for the treatment of cardiac arrhythmias.
Synonyms	N-Desbutyldronedarone hydrochloride D6; N-Desbutyl Dronedarone-d6 HCl; N-(2-Butyl-3-(4-(3-(butylamino)propoxy-1,1,2,2,3,3-d6)benzoyl)benzofuran-5-yl)methanesulfonamide Hydrochloride; Dronedarone Impurity D-d6; Dronedarone USP Related Compound A-d6
IUPAC Name	N-[2-butyl-3-[4-[3-(butylamino)-1,1,2,2,3,3-hexadeuteriopropoxy]benzoyl]-1-benzofuran-5-yl]methanesulfonamide;hydrochloride
Related CAS	197431-02-0 (unlabelled)
Canonical SMILES	CCCCC1=C(C2=C(O1)C=CC(=C2)NS(=O)(=O)C)C(=O)C3=CC=C(C=C3)OCCCNCCCC.Cl
InChI	InChI=1S/C27H36N2O5S.ClH/c1-4-6-9-25-26(23-19-21(29-35(3,31)32)12-15-24(23)34-25)27(30)20-10-13-22(14-11-20)33-18-8-17-28-16-7-5-2;/h10-15,19,28-29H,4-9,16-18H2,1-3H3;1H/i8D2,17D2,18D2;
InChI Key	ZDXBTJLIQYUYSZ-TWVPJIPGSA-N
Purity	>95%
Solubility	Soluble in Chloroform (Slightly), Methanol (Slightly)
Appearance	Light Brown Solid
Storage	Store at 2-8°C