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Ibutilide fumarate structure, CAS 122647-32-9

Ibutilide fumarate

CAS Number122647-32-9

SynonymsN-(4-{4-[Ethyl(heptyl)amino]-1-hydroxybutyl}phenyl)methanesulfonamide (2E)-but-2-enedioate (2:1); N-(4-{4-[Ethyl(heptyl)amino]-1-hydroxybutyl}phenyl)methanesulfonamide (2E)-2-butenedioate (2:1); (±)-4'-(4-(Ethylheptylamino)-1-hydroxybutyl)methanesulfoanilide (E)-2-Butenedioate (2:1); Ibutilide hemifumarate salt; Ibutilide fumarate; (2E)-But-2-endisäure--N-(4-{4-[ethyl(heptyl)amino]-1-hydroxybutyl}phenyl)methansulfonamid(1:2); Corvert; Ibutilide (fumarate)

Molecular FormulaC22H38N2O5S

Molecular Weight885.24

Purity98.00%

Density

Boiling Point522.4ºC at 760 mmHg

Melting Point112-117?C

Flash Point

AppearanceWhite off-white crystal-powder

EINECS

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Cat. No.: 2A-9051498 Purity: 98.00%
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Quality Control of [ 122647-32-9 ] Purity: 98.00% SDS Specification MoL

COA NMR CNMR HPLC LC-MS
Chemical & Physical Properties
CAS Number122647-32-9
Catalog No.2A-9051498
Chinese Name富马酸伊布利特
SynonymsN-(4-{4-[Ethyl(heptyl)amino]-1-hydroxybutyl}phenyl)methanesulfonamide (2E)-but-2-enedioate (2:1); N-(4-{4-[Ethyl(heptyl)amino]-1-hydroxybutyl}phenyl)methanesulfonamide (2E)-2-butenedioate (2:1); (±)-4'-(4-(Ethylheptylamino)-1-hydroxybutyl)methanesulfoanilide (E)-2-Butenedioate (2:1); Ibutilide hemifumarate salt; Ibutilide fumarate; (2E)-But-2-endisäure--N-(4-{4-[ethyl(heptyl)amino]-1-hydroxybutyl}phenyl)methansulfonamid(1:2); Corvert; Ibutilide (fumarate)
Molecular FormulaC22H38N2O5S
Molecular Weight885.24
Purity98.00
Boiling Point522.4ºC at 760 mmHg
Melting Point112-117?C
AppearanceWhite off-white crystal-powder
Storage ConditionRefrigerator
ApplicationIbutilide fumarate is a class III antiarrhythmic compound that can act on acute myocardial infarction.
MDL Number(C20H36N2O3S)2·C4H4O4
SMILESCCCCCCCN(CC)CCCC(O)c1ccc(NS(C)(=O)=O)cc1.CCCCCCCN(CC)CCCC(O)c1ccc(NS(C)(=O)=O)cc1.O=C(O)C=CC(=O)O
InChIInChI=1S/2C20H36N2O3S.C4H4O4/c2*1-4-6-7-8-9-16-22(5-2)17-10-11-20(23)18-12-14-19(15-13-18)21-26(3,24)25;5-3(6)1-2-4(7)8/h2*12-15,20-21,23H,4-11,16-17H2,1-3H3;1-2H,(H,5,6)(H,7,8)/b;;2-1+
InChI KeyPCIOHQNIRPWFMV-WXXKFALUSA-N
Hazard Symbolstransportation
MSDSmsds/51498_1_122647_32_9.pdf
BioactivityIbutilide Fumarate is a Class III antiarrhythmic agent that is indicated for acute cardioconversion of atrial fibrillation and atrial flutter of a recent onset to sinus rhythm.Target: Calcium ChannelIbutilide is the first 'pure' class III antiarrhythmic drug to become available. Its predominant action is prolongation of the myocardial action potential duration. Intravenous ibutilide 0.01 to 0.025 mg/kg or 1 to 2 mg successfully converted atrial flutter or fibrillation to sinus rhythm in 33 to 49% of patients in 2 placebo-controlled trials involving 439 patients with sustained arrhythmia [1]. Ibutilide appears to be an effective alternative method for rapid conversion of recent-onset AF or AFl. The drug may be particularly useful in patients who have undergone recent cardiac surgery or those who are not ideal candidates for DCC [2]. Related Catalog Signaling Pathways >> Membrane Transporter/Ion Channel >> Calcium Channel Research Areas >> Cardiovascular Disease References [1]. Foster, R.H., M.I. Wilde, and A. Markham, Ibutilide. A review of its pharmacological properties and clinical potential in the acute management of atrial flutter and fibrillation. Drugs, 1997. 54(2): p. 312-30. [2]. Howard, P.A., Ibutilide: an antiarrhythmic agent for the treatment of atrial fibrillation or flutter. Ann Pharmacother, 1999. 33(1): p. 38-47. Chemical & Physical Properties Boiling Point 522.4ºC at 760 mmHg Melting Point 112-117?C Molecular Formula C22H38N2O5S Molecular Weight 442.61 Flash Point 269.7ºC PSA 230.64000 LogP 10.34740 Vapour Pressure 9.71E-12mmHg at 25°C InChIKey PCIOHQNIRPWFMV-WXXKFALUSA-N SMILES CCCCCCCN(CC)CCCC(O)c1ccc(NS(C)(=O)=O)cc1.CCCCCCCN(CC)CCCC(O)c1ccc(NS(C)(=O)=O)cc1.O=C(O)C=CC(=O)O Storage condition Refrigerator
Use ofProperties Articles26 Name Ibutilide Hemifumarate Synonym More Synonyms Ibutilide fumarate Biological Activity Related Catalog Signaling Pathways >> Membrane Transporter/Ion Channel >> Calcium Channel Research Areas >> Cardiovascular Disease References [1]. Foster, R.H., M.I. Wilde, and A. Markham, Ibutilide. A review of its pharmacological properties and clinical potential in the acute management of atrial flutter and fibrillation. Drugs, 1997. 54(2): p. 312-30. [2]. Howard, P.A., Ibutilide: an antiarrhythmic agent for the treatment of atrial fibrillation or flutter. Ann Pharmacother, 1999. 33(1): p. 38-47. Chemical & Physical Properties Molecular Formula C22H38N2O5S PSA 230.64000 LogP 10.34740 InChIKey PCIOHQNIRPWFMV-WXXKFALUSA-N Storage condition Refrigerator
Transport InfoProduct name: Purity: 98.0%
MSDS Transport InfoModule 14. Shipping information 14.1 UN dangerous goods number European Land Transport Dangerous Regulations: -International Maritime Dangerous Regulations: -International Air Transport Dangerous Regulations: - 14.2 Names specified by the United Nations (UN) European Land Transport Dangerous Regulations: Non-dangerous goods IMDG Code: Non-dangerous goods International air transport dangerous goods regulations: non-dangerous goods 14.3 Transport hazard categories European Land Transport Dangerous Regulations: -International Maritime Dangerous Regulations: -International Air Transport Dangerous Regulations: - 14.4 Package group European Land Transport Dangerous Regulations: -International Maritime Dangerous Regulations: -International Air Transport Dangerous Regulations: - 14.5 Environmental hazards European Land Transport Dangerous Regulations: No International Maritime Transport Dangerous Regulations Maritime Pollutants: No International Air Transport Risk Regulations: No 14.6 Special reminder to users No data available
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