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51-06-9

51-06-9 structural image
Product Name: procainamide
Formula: C13H21N3O
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CHEMICAL AND PHYSICAL PROPERTIES

Physical Description Solid
Melting Point 165-169 °C
Solubility 5050 mg/L
LogP 0.88
Dissociation Constants 9.24
Kovats Retention Index 2193 2193 2250 2199.8 2240 2245 2248
Other Experimental Properties FREELY SOL IN WATER; SOL IN ALCOHOL; SLIGHTLY SOL IN CHLOROFORM; VERY SPARINGLY SOL IN BENZENE, ETHER; MP: 165-169 °C; MAX ABSORPTION: 278 NM; PH OF 10% AQ SOLN: 5.5 /HYDROCHLORIDE SALT/

COMPUTED DESCRIPTORS

Molecular Weight 235.33 g/mol
XLogP3 0.9
Hydrogen Bond Donor Count 2
Hydrogen Bond Acceptor Count 3
Rotatable Bond Count 6
Exact Mass 235.168462302 g/mol
Monoisotopic Mass 235.168462302 g/mol
Topological Polar Surface Area 58.4 Ų
Heavy Atom Count 17
Formal Charge 0
Complexity 221
Isotope Atom Count 0
Defined Atom Stereocenter Count 0
Undefined Atom Stereocenter Count 0
Defined Bond Stereocenter Count 0
Undefined Bond Stereocenter Count 0
Covalently-Bonded Unit Count 1
Compound Is Canonicalized Yes

PRODUCT INTRODUCTION

description

Procainamide is a benzamide that is 4-aminobenzamide substituted on the amide N by a 2-(diethylamino)ethyl group. It is a pharmaceutical antiarrhythmic agent used for the medical treatment of cardiac arrhythmias. It has a role as a sodium channel blocker, an anti-arrhythmia drug and a platelet aggregation inhibitor.