Bidisomide - ≥99% , CAS No.116078-65-0

CAS: 116078-65-0 Cat. No.: B649110 Molecular Weight: 407.98 PubChem CID: 59798

GRADE & PURITY ≥99%

Synonyms

Bidisomide (USAN/INN) | GTEPPJFJSNSNIH-UHFFFAOYSA-N | 1-PIPERIDINEBUTANAMIDE,A-[2-[ACETYL(1-METHYLETHYL)AMINO]ETHYL]-A-(2-CHLOROPHENYL)- | alpha-[2-[acetyl (1-methylethyl)amino]ethyl]-alpha-(2-chlorophenyl)-1-piperidinebutanamide | Bidisomidum | Bidisomid

Storage

Store at -20°C

Shipped In

Ice chest + Ice pads

Overview

Bidisomide (SC40230) is a class I antiarrhythmic agent.

In Vivo

The antiarrhythmic effects of Bidisomide, a new class I antiarrhythmic drug is investigated in early-phase ventricular arrhythmias induced by coronary artery occlusion and reperfusion in anesthetized rats. Bidisomide (5 mg/kg) reduces the number of premature ventricular complexes and the incidence of ventricular tachycardia and ventricular fibrillation similarly to Mexiletine (MXT) and Disopyramide (DSP) in rats with ventricular arrhythmias induced by coronary artery occlusion. In rats with ventricular arrhythmias induced by coronary artery reperfusion following a 5 min coronary occlusion, the antiarrhythmic effects of 5 mg/kg of Bidisomide are similar to those of the same doses of MXT and DSP. All three drugs significantly slow the heart rate . MCE has not independently confirmed the accuracy of these methods. They are for reference only.

Form:Solid

Specifications

Synonyms

Bidisomide (USAN/INN) | GTEPPJFJSNSNIH-UHFFFAOYSA-N | 1-PIPERIDINEBUTANAMIDE, A-[2-[ACETYL(1-METHYLETHYL)AMINO]ETHYL]-A-(2-CHLOROPHENYL)- | alpha-[2-[acetyl (1-methylethyl)amino]ethyl]-alpha-(2-chlorophenyl)-1-piperidinebutanamide | Bidisomidum | Bidisomid

Specifications & Purity

≥99%

Biochemical and Physiological Mechanisms

Bidisomide (SC40230) is a class I antiarrhythmic agent.

Storage

Store at -20°C

Shipped In

Ice chest + Ice pads

This product requires cold chain shipping. Ground and other economy services are not available.

Purity

≥99%

Names and Identifiers

• Canonical Smiles: CC(C)N(CCC(CCN1CCCCC1)(C2=CC=CC=C2Cl)C(=O)N)C(=O)C
• IUPAC Name: 2-[2-[acetyl(propan-2-yl)amino]ethyl]-2-(2-chlorophenyl)-4-piperidin-1-ylbutanamide
• InChIKey: GTEPPJFJSNSNIH-UHFFFAOYSA-N
• INCHI: 1S/C22H34ClN3O2/c1-17(2)26(18(3)27)16-12-22(21(24)28,19-9-5-6-10-20(19)23)11-15-25-13-7-4-8-14-25/h5-6,9-10,17H,4,7-8,11-16H2,1-3H3,(H2,24,28)
• Isomeric SMILES: CC(C)N(CCC(CCN1CCCCC1)(C2=CC=CC=C2Cl)C(=O)N)C(=O)C
• Alternate CAS: 116078-65-0
• PubChem CID: 59798
• MeSH Entry Terms: alpha-(2-(acetyl(1-methylethyl)amino)ethyl)-alpha-(2-chlorophenyl)-1-piperidinebutanamide;bidisomide;bidisomide, (+)-isomer;bidisomide, (+-)-isomer;bidisomide, (-)-isomer;SC 40230;SC-40230
• Molecular Weight: 407.98

Taxonomic Classification

Taxonomy Tree

• Kingdom Organic compounds
  • Superclass Benzenoids
    • Class Benzene and substituted derivatives
      • Subclass Phenylacetamides

• Kingdom: Organic compounds
• Superclass: Benzenoids
• Class: Benzene and substituted derivatives
• Subclass: Phenylacetamides
• Intermediate Tree Nodes: Not available
• Direct Parent: Phenylacetamides
• Alternative Parents: Aralkylamines Chlorobenzenes Piperidines Aryl chlorides Fatty amides Tertiary carboxylic acid amides Acetamides Trialkylamines Primary carboxylic acid amides Amino acids and derivatives Azacyclic compounds Organopnictogen compounds Hydrocarbon derivatives Organic oxides Organochlorides Carbonyl compounds
• Molecular Framework: Aromatic heteromonocyclic compounds
• Substituents: Phenylacetamide - Chlorobenzene - Halobenzene - Aralkylamine - Aryl chloride - Aryl halide - Fatty amide - Piperidine - Fatty acyl - Tertiary carboxylic acid amide - Acetamide - Tertiary aliphatic amine - Tertiary amine - Primary carboxylic acid amide - Amino acid or derivatives - Carboxamide group - Organoheterocyclic compound - Azacycle - Carboxylic acid derivative - Hydrocarbon derivative - Organohalogen compound - Organic oxygen compound - Organic nitrogen compound - Organochloride - Organonitrogen compound - Carbonyl group - Organic oxide - Organooxygen compound - Amine - Organopnictogen compound - Aromatic heteromonocyclic compound
• Description: This compound belongs to the class of organic compounds known as phenylacetamides. These are amide derivatives of phenylacetic acids.
• 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.

DOI: 10.1186/s13321-016-0174-y

Associated Targets(Human)

Homo sapiens (32628 Activities)

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Activity Type	Relation	Activity value	Units	Action Type	Journal	PubMed Id	doi	Assay Aladdin ID

Associated Targets(non-human)

Canis familiaris (36305 Activities)

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Activity Type	Relation	Activity value	Units	Action Type	Journal	PubMed Id	doi	Assay Aladdin ID

Mechanisms of Action

Chemical and Physical Properties

• Solubility: DMSO : 250 mg/mL (612.78 mM; Need ultrasonic)
• Molecular Weight: 408.000 g/mol
• XLogP3: 3.100
• Hydrogen Bond Donor Count: 1
• Hydrogen Bond Acceptor Count: 3
• Rotatable Bond Count: 9
• Exact Mass: 407.234 Da
• Monoisotopic Mass: 407.234 Da
• Topological Polar Surface Area: 66.600 Ų
• Heavy Atom Count: 28
• Formal Charge: 0
• Complexity: 522.000
• Isotope Atom Count: 0
• Defined Atom Stereocenter Count: 0
• Undefined Atom Stereocenter Count: 1
• Defined Bond Stereocenter Count: 0
• Undefined Bond Stereocenter Count: 0
• The total count of all stereochemical bonds: 0
• Covalently-Bonded Unit Count: 1