CAS 96027-74-6|Desethyl Amiodarone Hydrochloride

Introduction:Basic information about CAS 96027-74-6|Desethyl Amiodarone Hydrochloride, including its chemical name, molecular formula, synonyms, physicochemical properties, and safety information, etc.
Common NameDesethyl Amiodarone Hydrochloride
CAS Number96027-74-6Molecular Weight653.719
Density/Boiling Point630.3ºC at 760 mmHg
Molecular FormulaC23H26ClI2NO3Melting Point176-178ºC
MSDS/Flash Point335ºC
Symbol
GHS02, GHS06, GHS08
Signal WordDanger

Names

Name(2-butyl-1-benzofuran-3-yl)-[4-[2-(ethylamino)ethoxy]-3,5-diiodophenyl]methanone,hydrochloride
SynonymMore Synonyms

Desethyl Amiodarone Hydrochloride BiologicalActivity

DescriptionDesethylamiodarone hydrochloride (N-desethylamiodarone hydrochloride) is a major active metabolite of Amiodarone. Desethylamiodarone hydrochloride is formed by CYP3A isoenzymes. Amiodarone is an antiarrhythmic agent for inhibition of ATP-sensitive potassium channel with an IC50 of 19.1 μM[1][2][3].
Related CatalogResearch Areas >>Cardiovascular DiseaseSignaling Pathways >>Autophagy >>AutophagySignaling Pathways >>Membrane Transporter/Ion Channel >>Potassium Channel
References

[1]. Shayeganpour A, et al. Determination of the enzyme(s) involved in the metabolism of amiodarone in liver and intestine of rat: the contribution of cytochrome P450 3A isoforms. Drug Metab Dispos. 2006 Jan;34(1):43-50.

[2]. Singh, B.N. and E.M. Vaughan Williams, The effect of amiodarone, a new anti-anginal drug, on cardiac muscle. Br J Pharmacol, 1970. 39(4): p. 657-67.

[3]. Rosenbaum, M.B., et al., Clinical efficacy of amiodarone as an antiarrhythmic agent. Am J Cardiol, 1976. 38(7): p. 934-44.

Chemical & Physical Properties

Boiling Point630.3ºC at 760 mmHg
Melting Point176-178ºC
Molecular FormulaC23H26ClI2NO3
Molecular Weight653.719
Flash Point335ºC
Exact Mass652.969055
PSA51.47000
LogP7.39680
InChIKeyOCQPMJVGWGJLLG-UHFFFAOYSA-N
SMILESCCCCc1oc2ccccc2c1C(=O)c1cc(I)c(OCCNCC)c(I)c1.Cl
Storage condition-20°C Freezer, Under Inert Atmosphere
StabilityMoisture Sensitive

Safety Information

Symbol
GHS02, GHS06, GHS08
Signal WordDanger
Hazard StatementsH225-H301 + H311 + H331-H370
Precautionary StatementsP210-P260-P280-P301 + P310-P311
Hazard CodesF,T
Risk Phrases11-23/24/25-39/23/24/25
Safety Phrases7-16-36/37-45
RIDADRUN1230 - class 3 - PG 2 - Methanol, solution

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Synonyms

Desethylamiodarone hydrochloride
desethylamiodarone
(2-Butyl-1-benzofuran-3-yl){4-[2-(ethylamino)ethoxy]-3,5-diiodophenyl}methanone hydrochloride (1:1)
Methanone, (2-butyl-3-benzofuranyl)[4-[2-(ethylamino)ethoxy]-3,5-diiodophenyl]-, hydrochloride (1:1)
mono-N-desethylamiodarone hydrochloride
Desethyl Amiodarone Hydrochloride
Amiodarone Impurity 2
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