Coluracetam - ≥98% , CAS No.135463-81-9

CAS: 135463-81-9 Cat. No.: C190679 Summenformel: C₁₉H₂₃N₃O₃ Molekulargewicht: 341.4

GRADE & PURITY ≥98%

Synonyms

DS-14004 | DTXSID60159386 | AC-31948 | C3689 | Coluracetam;MKC-231;BCI-540 | FT-0697594 | F16433 | A857829 | Coluracetam | N-{2,3-DIMETHYL-5H,6H,7H,8H-FURO[2,3-B]QUINOLIN-4-YL}-2-(2-OXOPYRROLIDIN-1-YL)ACETAMID | NCGC00378715-01 | MKC 231 | MKC-231 | Q368

Storage

Raumtemperatur, Argon geladen

Shipped In

Normal

Übersicht

Produkteinführung：

Coluracetam (MKC-231) ist ein Enhancer der Cholin-Aufnahme.

Specifications

Synonyme

DS-14004 | DTXSID60159386 | AC-31948 | C3689 | Coluracetam;MKC-231;BCI-540 | FT-0697594 | F16433 | A857829 | Coluracetam | N-{2,3-DIMETHYL-5H,6H,7H,8H-FURO[2,3-B]QUINOLIN-4-YL}-2-(2-OXOPYRROLIDIN-1-YL)ACETAMID | NCGC00378715-01 | MKC 231 | MKC-231 | Q368

Spezifikationen & Reinheit

≥98%

Storage

Raumtemperatur, Argon geladen

Verschickt in

Normal

Reinheit

≥98%

Namen und Kennungen

• Pubchem Sid: 488188629
• Pubchem Sid Url: https://pubchem.ncbi.nlm.nih.gov/substance/488188629
• Kanonisches Lächeln: CC1=C(OC2=NC3=C(CCCC3)C(=C12)NC(=O)CN4CCCC4=O)C
• IUPAC Name: N-(2,3-dimethyl-5,6,7,8-tetrahydrofuro[2,3-b]quinolin-4-yl)-2-(2-oxopyrrolidin-1-yl)acetamide
• InChIKey: PSPGQHXMUKWNDI-UHFFFAOYSA-N
• INCHI: 1S/C19H23N3O3/c1-11-12(2)25-19-17(11)18(13-6-3-4-7-14(13)20-19)21-15(23)10-22-9-5-8-16(22)24/h3-10H2,1-2H3,(H,20,21,23)
• Isomere SMILES: CC1=C(OC2=NC3=C(CCCC3)C(=C12)NC(=O)CN4CCCC4=O)C
• Molekulargewicht: 341.4
• Reaxy-Rn: 7497180
• Reaxys-RN_link_address: https://www.reaxys.com/reaxys/secured/hopinto.do?context=S&query=IDE.XRN=7497180&ln=

Taxonomic Classification

Taxonomy Tree

• Kingdom Organic compounds
  • Superclass Organic acids and derivatives
    • Klasse Carboxylic acids and derivatives
      • Subclass Amino acids, peptides, and analogues
        • Ebene5 Amino acids and derivatives
          • Ebene6 Alpha amino acids and derivatives

• Kingdom: Organic compounds
• Superclass: Organic acids and derivatives
• Klasse: Carboxylic acids and derivatives
• Subclass: Amino acids, peptides, and analogues
• Intermediate Tree Nodes: Amino acids and derivatives
• Direct Parent: Alpha amino acids and derivatives
• Alternative Parents: Furopyridines N-arylamides N-alkylpyrrolidines Pyridines and derivatives Pyrrolidine-2-ones Heteroaromatic compounds Tertiary carboxylic acid amides Furans Secondary carboxylic acid amides Lactams Azacyclic compounds Oxacyclic compounds Organopnictogen compounds Organic oxides Hydrocarbon derivatives Carbonyl compounds
• Molecular Framework: Aromatic heteropolycyclic compounds
• Substituents: Alpha-amino acid or derivatives - Furopyridine - N-arylamide - Pyridine - Pyrrolidone - 2-pyrrolidone - N-alkylpyrrolidine - Furan - Pyrrolidine - Tertiary carboxylic acid amide - Heteroaromatic compound - Secondary carboxylic acid amide - Lactam - Carboxamide group - Organoheterocyclic compound - Azacycle - Oxacycle - Hydrocarbon derivative - Carbonyl group - Organic oxide - Organopnictogen compound - Organic oxygen compound - Organooxygen compound - Organonitrogen compound - Organic nitrogen compound - Aromatic heteropolycyclic compound
• Beschreibung: This compound belongs to the class of organic compounds known as alpha amino acids and derivatives. These are amino acids in which the amino group is attached to the carbon atom immediately adjacent to the carboxylate group (alpha carbon), or a derivative thereof.
• 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

Zugehörige Ziele (nicht menschlich)

Hdac6 Histone deacetylase 6 (222 Activities)

Discover Target: Hdac6

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Rattus norvegicus (775804 Activities)

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rep Replicase polyprotein 1ab (378 Activities)

Discover Target: rep

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Wirkungsmechanismen

Chemische und physikalische Eigenschaften

• Empfindlichkeit: Air Sensitive
• Schmelzpunkt (°C): 225 °C
• Molekulargewicht: 341.400 g/mol
• XLogP3: 2.400
• Hydrogen Bond Donor Count: 1
• Hydrogen Bond Acceptor Count: 4
• Rotatable Bond Count: 3
• Exact Mass: 341.174 Da
• Monoisotopic Mass: 341.174 Da
• Topological Polar Surface Area: 75.400 Ų
• Heavy Atom Count: 25
• Formal Charge: 0
• Complexity: 540.000
• 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: 1