Lenperone - ≥95% , CAS No.24678-13-5

CAS: 24678-13-5 Cat. No.: L354307 Summenformel: C₂₂H₂₃F₂NO₂ Molekulargewicht: 371.42

GRADE & PURITY ≥95%

Synonyms

1-(4-Fluorophenyl)-4-{4-[(4-fluorophenyl)carbonyl]piperidin-1-yl}butan-1-one | EINECS 246-399-7 | FT-0670760 | LENPERONE [WHO-DD] | Lenperonum | MLS001205808 | 5-21-08-00146 (Beilstein Handbook Reference) | LENPERONE [INN] | 4-[4-(4-Fluoro-benzoyl)-piperi

Storage

Store at 2-8°C

Shipped In

Wet ice

Übersicht

Lenperone is a neuroleptic butyrophenone. Lenperone is an effective atypical antipsychotic drug used in the treatment of schizophrenia.

Specifications

Synonyme

1-(4-Fluorophenyl)-4-{4-[(4-fluorophenyl)carbonyl]piperidin-1-yl}butan-1-one | EINECS 246-399-7 | FT-0670760 | LENPERONE [WHO-DD] | Lenperonum | MLS001205808 | 5-21-08-00146 (Beilstein Handbook Reference) | LENPERONE [INN] | 4-[4-(4-Fluoro-benzoyl)-piperi

Spezifikationen & Reinheit

≥95%

Storage

Store at 2-8°C

Verschickt in

Wet ice

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

Reinheit

≥95%

Namen und Kennungen

• Pubchem Sid: 504753489
• Pubchem Sid Url: https://pubchem.ncbi.nlm.nih.gov/substance/504753489
• Kanonisches Lächeln: C1CN(CCC1C(=O)C2=CC=C(C=C2)F)CCCC(=O)C3=CC=C(C=C3)F
• IUPAC Name: 4-[4-(4-fluorobenzoyl)piperidin-1-yl]-1-(4-fluorophenyl)butan-1-one
• InChIKey: WCIBOXFOUGQLFC-UHFFFAOYSA-N
• INCHI: 1S/C22H23F2NO2/c23-19-7-3-16(4-8-19)21(26)2-1-13-25-14-11-18(12-15-25)22(27)17-5-9-20(24)10-6-17/h3-10,18H,1-2,11-15H2
• Isomere SMILES: C1CN(CCC1C(=O)C2=CC=C(C=C2)F)CCCC(=O)C3=CC=C(C=C3)F
• Molekulargewicht: 371.42
• Reaxy-Rn: 1554429
• Reaxys-RN_link_address: https://www.reaxys.com/reaxys/secured/hopinto.do?context=S&query=IDE.XRN=1554429&ln=

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: Phenylbutylamines Butyrophenones Benzoyl derivatives Aryl alkyl ketones Fluorobenzenes Piperidines Gamma-amino ketones Aryl fluorides Trialkylamines Azacyclic compounds Organopnictogen compounds Organofluorides Organic oxides Hydrocarbon derivatives
• Molecular Framework: Aromatic heteromonocyclic compounds
• Substituents: Alkyl-phenylketone - Butyrophenone - Phenylbutylamine - Benzoyl - Aryl alkyl ketone - Fluorobenzene - Halobenzene - Aryl fluoride - Aryl halide - Monocyclic benzene moiety - Benzenoid - Gamma-aminoketone - Piperidine - Tertiary aliphatic amine - Tertiary amine - Organoheterocyclic compound - Azacycle - Organohalogen compound - Organic oxide - Organopnictogen compound - Amine - Hydrocarbon derivative - Organic nitrogen compound - Organofluoride - Organonitrogen compound - 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

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HTR1A Tclin Serotonin 1a (5-HT1a) receptor (14969 Activities)

Discover Target: HTR1A

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VDR Tclin Vitamin D receptor (26531 Activities)

Discover Target: VDR

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HTR2C Tclin Serotonin 2c (5-HT2c) receptor (11471 Activities)

Discover Target: HTR2C

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PTH1R Tclin Parathyroid hormone receptor (47172 Activities)

Discover Target: PTH1R

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TDP1 Tchem Tyrosyl-DNA phosphodiesterase 1 (345557 Activities)

Discover Target: TDP1

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GMNN Tbio Geminin (128009 Activities)

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Zugehörige Ziele (nicht menschlich)

ampC Beta-lactamase AmpC (62480 Activities)

Discover Target: ampC

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Plasmodium falciparum (966862 Activities)

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Htr2b Serotonin 2 (5-HT2) receptor (2078 Activities)

Discover Target: Htr2b

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Wirkungsmechanismen

Chemische und physikalische Eigenschaften

• Löslichkeit: Chloroform (Slightly), DMSO (Slightly)
• Siedepunkt (°C): 457.9-557.9 °C at 760 mmHg (Predicted)
• Schmelzpunkt (°C): 131-134°C
• Molekulargewicht: 371.400 g/mol
• XLogP3: 4.000
• Hydrogen Bond Donor Count: 0
• Hydrogen Bond Acceptor Count: 5
• Rotatable Bond Count: 7
• Exact Mass: 371.17 Da
• Monoisotopic Mass: 371.17 Da
• Topological Polar Surface Area: 37.400 Ų
• Heavy Atom Count: 27
• Formal Charge: 0
• Complexity: 489.000
• 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

Häufig gestellte Fragen

What is the purity of this product?

This product is supplied at ≥95% purity (chemical assay). Lot-specific values are stated on the Certificate of Analysis.

How should this product be stored?

Store at 2–8 °C. Refrigerated storage is required to maintain the specified shelf life.

How is this product shipped?

This product ships chilled on wet ice. Unpack on arrival and transfer it to the storage condition stated above.

What are the CAS number, molecular formula and molecular weight?

The CAS Number is 24678-13-5, the molecular formula is C22H23F2NO2, and the molecular weight is 371.42 g/mol. InChIKey WCIBOXFOUGQLFC-UHFFFAOYSA-N.

What documentation is provided?

Available product documentation, including Certificates of Analysis (COA), Safety Data Sheets (SDS), and specification sheets, is shown in the product document area. Document availability and access follow the current site policy.