Clorhidrato de L-741,742 - ≥98%(HPLC) , CAS No.874882-93-6

CAS: 874882-93-6 Cat. No.: L288128 Peso molecular: 417.38 PubChem CID: 24744861

GRADE & PURITY ≥98%(HPLC)

Synonyms

C22H31N3O3.2HCl | SR-01000597843 | SR-01000597843-1 | 79Y3N86U2E | UNII-79Y3N86U2E | AKOS024456331 | L 741742 | 8-[2-[4-(metoxifenil)-1-piperazin yl]etil]-8-azaspiro[4.5]decane-7,9-diona dihidrocloruro | L-741,742Hidrocloruro | 4-[5-(4-clorofenil)-

Storage

Conservar a -20°C

Shipped In

Hielera + almohadillas de hielo

Descripción general

Descripción del producto:

antagonista altamente potente y selectivo del receptor dopaminérgico D4.

Specifications

Sinónimos

C22H31N3O3.2HCl | SR-01000597843 | SR-01000597843-1 | 79Y3N86U2E | UNII-79Y3N86U2E | AKOS024456331 | L 741742 | 8-[2-[4-(metoxifenil)-1-piperazin yl]etil]-8-azaspiro[4.5]decane-7, 9-diona dihidrocloruro | L-741, 742Hidrocloruro | 4-[5-(4-clorofenil)-

Especificaciones y pureza

≥98%(HPLC)

Mecanismos bioquímicos y fisiológicos

Un potente y altamente selectivo antagonista de los receptores de D4dopamina, con Kivalues de > 1700, 770 y 3.5 nM en los receptores humanos clonados D2, D3y D4.

Condiciones de almacenamiento de almacenamiento

Conservar a -20°C

Enviado en

Hielera + almohadillas de hielo

Tipo de acción

ANTAGONIST

Pureza

≥98%(HPLC)

Nombres e identificadores

• Sonrisas canónicas: CC1=C(ON=C1C2CCN(CC2)CCC3=CC=CC=C3)C4=CC=C(C=C4)Cl.Cl
• IUPAC Name: 5-(4-chlorophenyl)-4-methyl-3-[1-(2-phenylethyl)piperidin-4-yl]-1,2-oxazole;hydrochloride
• InChIKey: HZRPUQURUAXOHB-UHFFFAOYSA-N
• INCHI: 1S/C23H25ClN2O.ClH/c1-17-22(25-27-23(17)20-7-9-21(24)10-8-20)19-12-15-26(16-13-19)14-11-18-5-3-2-4-6-18;/h2-10,19H,11-16H2,1H3;1H
• Isómeros SMILES: CC1=C(ON=C1C2CCN(CC2)CCC3=CC=CC=C3)C4=CC=C(C=C4)Cl.Cl
• PubChem CID: 24744861
• Peso molecular: 417.38

Taxonomic Classification

Taxonomy Tree

• Kingdom Organic compounds
  • Superclass Benzenoids
    • Clase Benzene and substituted derivatives
      • Subclass Phenethylamines

• Kingdom: Organic compounds
• Superclass: Benzenoids
• Clase: Benzene and substituted derivatives
• Subclass: Phenethylamines
• Intermediate Tree Nodes: Not available
• Direct Parent: Phenethylamines
• Alternative Parents: Chlorobenzenes Aralkylamines Piperidines Aryl chlorides Isoxazoles Heteroaromatic compounds Trialkylamines Oxacyclic compounds Azacyclic compounds Organooxygen compounds Organochlorides Hydrochlorides Hydrocarbon derivatives
• Molecular Framework: Aromatic heteromonocyclic compounds
• Substituents: Phenethylamine - Chlorobenzene - Halobenzene - Aralkylamine - Aryl chloride - Piperidine - Aryl halide - Heteroaromatic compound - Azole - Isoxazole - Tertiary aliphatic amine - Tertiary amine - Oxacycle - Azacycle - Organoheterocyclic compound - Organic oxygen compound - Organochloride - Organohalogen compound - Organonitrogen compound - Amine - Organooxygen compound - Organic nitrogen compound - Hydrochloride - Hydrocarbon derivative - Aromatic heteromonocyclic compound
• Descripción: This compound belongs to the class of organic compounds known as phenethylamines. These are compounds containing a phenethylamine moiety, which consists of a phenyl group substituted at the second position by an ethan-1-amine.
• 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

Propiedades químicas y físicas

• Solubilidad: Solvent:DMSO, Max Conc. mg/mL: 4.17, Max Conc. mM: 10
• Peso molecular: 417.400 g/mol
• Hydrogen Bond Donor Count: 1
• Hydrogen Bond Acceptor Count: 3
• Rotatable Bond Count: 5
• Exact Mass: 416.142 Da
• Monoisotopic Mass: 416.142 Da
• Topological Polar Surface Area: 29.300 Ų
• Heavy Atom Count: 28
• Formal Charge: 0
• Complexity: 440.000
• 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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