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N-Acetylprocainamide hydrochloride - 98% (HPLC), high purity , CAS No.34118-92-8
Basic Description
Synonyms
A20512 | Acecainide hydrochloride | NCGC00015072-10 | Tox21_500009 | Benzylpenicillin G | J-019456 | SCHEMBL122991 | SMR000059132 | SPECTRUM2300154 | AS-75674 | N16908 | Benzamide, 4-(acetylamino)-N-(2-(diethylamino)ethyl)-, monohydrochloride | Riboazaura
Specifications & Purity
≥98%(HPLC)
Biochemical and Physiological Mechanisms
Class III antiarrhythmic. Increases the duration of the action potential by decreasing the delayed outward potassium current, slightly decreasing the calcium current, and slightly depressing the inward rectifier potassium current. This is the active metab
Storage Temp
Store at -20°C
Shipped In
Ice chest + Ice pads
This product requires cold chain shipping. Ground and other economy services are not available.
Taxonomic Classification
Kingdom
Organic compounds
Superclass
Benzenoids
Class
Benzene and substituted derivatives
Subclass
Benzoic acids and derivatives
Intermediate Tree Nodes
Not available
Direct Parent
Acylaminobenzoic acid and derivatives
Alternative Parents
Acetanilides N-acetylarylamines Benzamides Benzoyl derivatives Acetamides Trialkylamines Secondary carboxylic acid amides Amino acids and derivatives Organopnictogen compounds Organic oxides Hydrochlorides Hydrocarbon derivatives Carbonyl compounds
Molecular Framework
Aromatic homomonocyclic compounds
Substituents
Acylaminobenzoic acid or derivatives - Acetanilide - Benzamide - N-acetylarylamine - Anilide - Benzoyl - N-arylamide - Acetamide - Amino acid or derivatives - Carboxamide group - Tertiary aliphatic amine - Tertiary amine - Secondary carboxylic acid amide - Carboxylic acid derivative - Amine - Organooxygen compound - Organonitrogen compound - Hydrochloride - Hydrocarbon derivative - Carbonyl group - Organic oxide - Organopnictogen compound - Organic oxygen compound - Organic nitrogen compound - Aromatic homomonocyclic compound
Description
This compound belongs to the class of organic compounds known as acylaminobenzoic acid and derivatives. These are derivatives of amino benzoic acid derivatives where the amine group is N-acylated.
External Descriptors
Not available
Data sources
1. Djoumbou Feunang Y, Eisner R, Knox C, Chepelev L, Hastings J, Owen G, Fahy E, Steinbeck C, Subramanian S, Bolton E, Greiner R, and Wishart DS. ClassyFire: Automated Chemical Classification With A Comprehensive, Computable Taxonomy. Journal of Cheminformatics, 2016, 8:61.
Associated Targets(Human)
Associated Targets(non-human)
Mechanisms of Action
Mechanism of Action
Action Type
target ID
Target Name
Target Type
Target Organism
Binding Site Name
References
Names and Identifiers
Pubchem Sid
504754624
Pubchem Sid Url
https://pubchem.ncbi.nlm.nih.gov/substance/504754624
IUPAC Name
4-acetamido-N-[2-(diethylamino)ethyl]benzamide;hydrochloride
INCHI
InChI=1S/C15H23N3O2.ClH/c1-4-18(5-2)11-10-16-15(20)13-6-8-14(9-7-13)17-12(3)19;/h6-9H,4-5,10-11H2,1-3H3,(H,16,20)(H,17,19);1H
InChIKey
IYEWBJUCJHKLHD-UHFFFAOYSA-N
Smiles
CCN(CC)CCNC(=O)C1=CC=C(C=C1)NC(=O)C.Cl
Isomeric SMILES
CCN(CC)CCNC(=O)C1=CC=C(C=C1)NC(=O)C.Cl
WGK Germany
3
Molecular Weight
313.82
Reaxy-Rn
6548563
Reaxys-RN_link_address
https://www.reaxys.com/reaxys/secured/hopinto.do?context=S&query=IDE.XRN=6548563&ln=
Certificates(CoA,COO,BSE/TSE and Analysis Chart)
Chemical and Physical Properties
Solubility
H2O: 50 mg/mL
Sensitivity
Moisture sensitive.
Melt Point(°C)
184-186 °C
Molecular Weight
313.820 g/mol
XLogP3
Hydrogen Bond Donor Count
3
Hydrogen Bond Acceptor Count
3
Rotatable Bond Count
7
Exact Mass
313.156 Da
Monoisotopic Mass
313.156 Da
Topological Polar Surface Area
61.400 Ų
Heavy Atom Count
21
Formal Charge
0
Complexity
308.000
Isotope Atom Count
0
Defined Atom Stereocenter Count
0
Undefined Atom Stereocenter Count
0
Defined Bond Stereocenter Count
0
Undefined Bond Stereocenter Count
0
The total count of all stereochemical bonds
0
Covalently-Bonded Unit Count
2
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