1-(1-Adamantyl)ethylamine hydrochloride - 10mM in DMSO , CAS No.1501-84-4

CAS: 1501-84-4 Cat. No.: A421767 Peso molecular: 215.77 Número EC: 604-725-9

GRADE & PURITY 10mM in DMSO

Synonyms

Rimantadine hydrochloride|1501-84-4|Flumadine|Rimantadine HCL|Meradane|1-(1-ADAMANTYL)ETHYLAMINE HYDROCHLORIDE|EXP 126|alpha-Methyl-1-adamantanemethylamine hydrochloride|1-(Adamantan-1-yl)ethanamine hydrochloride|Rimantadine (hydrochloride)|1-(1-Aminoethy

Storage

Store at -80°C

Shipped In

Dry ice packs + Cold packs

Descripción general

Product Application:

1-(1-Adamantyl)ethylamine hydrochloride is indicated for the prophylaxis and treatment of illness caused by various strains of influenza A virus in adults (17 years and older).

Specifications

Sinónimos

Rimantadine hydrochloride | 1501-84-4 | Flumadine | Rimantadine HCL | Meradane | 1-(1-ADAMANTYL)ETHYLAMINE HYDROCHLORIDE | EXP 126 | alpha-Methyl-1-adamantanemethylamine hydrochloride | 1-(Adamantan-1-yl)ethanamine hydrochloride | Rimantadine (hydrochloride) | 1-(1-Aminoethy

Especificaciones y pureza

10mM in DMSO

Mecanismos bioquímicos y fisiológicos

M2 proton channel inhibitor. Inhibits influenza A virus in vivo. Shows greater blood-brain barrier permeability than amantadine hydrochloride . Orally active.

Condiciones de almacenamiento de almacenamiento

Store at -80°C

Enviado en

Dry ice packs + Cold packs

Este producto requiere envío en cadena de frío. Los servicios terrestres y otros servicios económicos no están disponibles.

Tipo de acción

INHIBITOR

Nombres e identificadores

• Sonrisas canónicas: CC(C12CC3CC(C1)CC(C3)C2)N.Cl
• IUPAC Name: 1-(1-adamantyl)ethanamine;hydrochloride
• InChIKey: OZBDFBJXRJWNAV-UHFFFAOYSA-N
• INCHI: 1S/C12H21N.ClH/c1-8(13)12-5-9-2-10(6-12)4-11(3-9)7-12;/h8-11H,2-7,13H2,1H3;1H
• Isómeros SMILES: CC(C12CC3CC(C1)CC(C3)C2)N.Cl
• WGK Alemania: 3
• RTECS: AU4717000
• Peso molecular: 215.77
• Reaxy-Rn: 3623918
• Reaxys-RN_link_address: https://www.reaxys.com/reaxys/secured/hopinto.do?context=S&query=IDE.XRN=3623918&ln=

Taxonomic Classification

Taxonomy Tree

• Kingdom Organic compounds
  • Superclass Organic nitrogen compounds
    • Clase Organonitrogen compounds
      • Subclass Amines
        • Level5 Primary amines
          • Level6 Monoalkylamines

• Kingdom: Organic compounds
• Superclass: Organic nitrogen compounds
• Clase: Organonitrogen compounds
• Subclass: Amines
• Intermediate Tree Nodes: Primary amines
• Direct Parent: Monoalkylamines
• Alternative Parents: Organopnictogen compounds Hydrochlorides Hydrocarbon derivatives
• Molecular Framework: Aliphatic homopolycyclic compounds
• Substituents: Organopnictogen compound - Hydrocarbon derivative - Hydrochloride - Primary aliphatic amine - Aliphatic homopolycyclic compound
• Descripción: This compound belongs to the class of organic compounds known as monoalkylamines. These are organic compounds containing an primary aliphatic amine group.
• External Descriptors: organic molecular entity

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

• Punto de fusión (°C): 375°C
• Peso molecular: 215.760 g/mol
• Hydrogen Bond Donor Count: 2
• Hydrogen Bond Acceptor Count: 1
• Rotatable Bond Count: 1
• Exact Mass: 215.144 Da
• Monoisotopic Mass: 215.144 Da
• Topological Polar Surface Area: 26.000 Ų
• Heavy Atom Count: 14
• Formal Charge: 0
• Complexity: 180.000
• 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: 2

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