S 24795 - ≥98% , CAS No.304679-75-2

CAS: 304679-75-2 Cat. No.: S287505 Summenformel: C₁₄H₁₃BrINO Molekulargewicht: 418.07 EG-Nummer: 808-959-4 PubChem CID: 9888248

GRADE & PURITY ≥98%

Synonyms

S 24795 | HY-11053 | S 24795, >=98% (HPLC) | 2-[2-(4-bromophenyl)-2-oxoethyl]-1-methylpyridiniumiodide | 2-[2-(4-Bromophenyl)-2-oxoethyl]-1-methylpyridinium iodide | AKOS024457657 | s-24795 | 1-(4-bromophenyl)-2-(1-methylpyridin-1-ium-2-yl)ethanone;iodide

Storage

Protected from light,Store at -20°C

Shipped In

Ice chest + Ice pads

Specifications

Synonyme

S 24795 | HY-11053 | S 24795, >=98% (HPLC) | 2-[2-(4-bromophenyl)-2-oxoethyl]-1-methylpyridiniumiodide | 2-[2-(4-Bromophenyl)-2-oxoethyl]-1-methylpyridinium iodide | AKOS024457657 | s-24795 | 1-(4-bromophenyl)-2-(1-methylpyridin-1-ium-2-yl)ethanone;iodide

Spezifikationen & Reinheit

≥98%

Biochemische und physiologische Mechanismen

Partial agonist ofα7 nAChR. Improves mnemonic function in aged mice for the treatment of aging-related memory disturbances. Displays more efficient memory-enhancing effects thanmemantine in Alzheimer's disease mouse models.

Storage

Protected from light,Store at -20°C

Verschickt in

Ice chest + Ice pads

Dieses Produkt erfordert Kühlkettenversand. Grundversand und andere Economy-Optionen sind nicht verfügbar.

Reinheit

≥98%

Namen und Kennungen

• Pubchem Sid: 528766982
• Kanonisches Lächeln: C[N+]1=CC=CC=C1CC(=O)C2=CC=C(C=C2)Br.[I-]
• IUPAC Name: 1-(4-bromophenyl)-2-(1-methylpyridin-1-ium-2-yl)ethanone;iodide
• InChIKey: LERUHBBUGAOYOD-UHFFFAOYSA-M
• INCHI: 1S/C14H13BrNO.HI/c1-16-9-3-2-4-13(16)10-14(17)11-5-7-12(15)8-6-11;/h2-9H,10H2,1H3;1H/q+1;/p-1
• Isomere SMILES: C[N+]1=CC=CC=C1CC(=O)C2=CC=C(C=C2)Br.[I-]
• PubChem CID: 9888248
• Molekulargewicht: 418.07

Taxonomic Classification

Taxonomy Tree

• Kingdom Organic compounds
  • Superclass Organic oxygen compounds
    • Klasse Organooxygen compounds
      • Subclass Carbonyl compounds
        • Ebene5 Ketones
          • Ebene6 Aryl ketones
            • Ebene7 Phenylketones
              • Ebene8 Alkyl-phenylketones

• Kingdom: Organic compounds
• Superclass: Organic oxygen compounds
• Klasse: Organooxygen compounds
• Subclass: Carbonyl compounds
• Intermediate Tree Nodes: Ketones - Aryl ketones - Phenylketones
• Direct Parent: Alkyl-phenylketones
• Alternative Parents: Benzoyl derivatives Aryl alkyl ketones N-methylpyridinium compounds Bromobenzenes Pyridinium derivatives Aryl bromides Heteroaromatic compounds Azacyclic compounds Organonitrogen compounds Organobromides Organic oxides Organic iodide salts Hydrocarbon derivatives Organic cations
• Molecular Framework: Aromatic heteromonocyclic compounds
• Substituents: Alkyl-phenylketone - Benzoyl - Aryl alkyl ketone - N-methylpyridinium - Bromobenzene - Halobenzene - Aryl bromide - Aryl halide - Monocyclic benzene moiety - Pyridine - Benzenoid - Pyridinium - Heteroaromatic compound - Azacycle - Organoheterocyclic compound - Organonitrogen compound - Organobromide - Organohalogen compound - Organic nitrogen compound - Organic iodide salt - Hydrocarbon derivative - Organic oxide - Organic salt - Organic cation - Aromatic heteromonocyclic compound
• Beschreibung: This compound belongs to the class of organic compounds known as alkyl-phenylketones. These are aromatic compounds containing a ketone substituted by one alkyl group, and a phenyl group.
• 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

Chemische und physikalische Eigenschaften

• Löslichkeit: Solvent:water, Max Conc. mg/mL: 4.18, Max Conc. mM: 10 with gentle warming; Solvent:DMSO, Max Conc. mg/mL: 41.81, Max Conc. mM: 100
• Empfindlichkeit: light sensitive
• Molekulargewicht: 418.070 g/mol
• Hydrogen Bond Donor Count: 0
• Hydrogen Bond Acceptor Count: 2
• Rotatable Bond Count: 3
• Exact Mass: 416.923 Da
• Monoisotopic Mass: 416.923 Da
• Topological Polar Surface Area: 21.000 Ų
• Heavy Atom Count: 18
• Formal Charge: 0
• Complexity: 261.000
• 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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