Medetomidina HCl - ≥99% , CAS No.86347-15-1

CAS: 86347-15-1 Cat. No.: M129911 Peso molecular: 236.74 Número EC: 645-306-0

GRADE & PURITY ≥99%

Synonyms

(+/-)-4-(.ALFA.,2,3-TRIMETHYLBENZYL)IMIDAZOLE MONOHYDROCHLORIDE | 1246820-20-1 | 4-[1-(2,3-dimethylphenyl)ethyl]-1H-imidazole hydrochloride | FT-0645167 | (+/-)-5-[1-(2,3-dimethylphenyl)ethyl]-1H-imidazole hydrochloride | 1H-Imidazole, 4-(1-(2,3-dimethyl)

Storage

Conservar a -20°C

Shipped In

Hielera + almohadillas de hielo

Descripción general

La medetomidina es un agonista selectivo de los receptores adrenérgicos α2, con un Ki de 1,08 nM, que presenta una selectividad 1620 veces mayor que los receptores adrenérgicos α1

Specifications

Sinónimos

(+/-)-4-(.ALFA., 2, 3-TRIMETHYLBENZYL)IMIDAZOLE MONOHYDROCHLORIDE | 1246820-20-1 | 4-[1-(2, 3-dimethylphenyl)ethyl]-1H-imidazole hydrochloride | FT-0645167 | (+/-)-5-[1-(2, 3-dimethylphenyl)ethyl]-1H-imidazole hydrochloride | 1H-Imidazole, 4-(1-(2, 3-dimethyl)

Especificaciones y pureza

≥99%

Mecanismos bioquímicos y fisiológicos

El clorhidrato de medetomidina es un agonista del receptor alfa-2 adrenérgico, que se utiliza en medicina veterinaria por sus propiedades analgésicas y sedantes.Agonista adrenoceptor α 2 selectivo (los valores de K i para los subtipos de receptores son 3,

Condiciones de almacenamiento de almacenamiento

Conservar a -20°C

Enviado en

Hielera + almohadillas de hielo

Nota

Siempre que sea posible, prepare y utilice las soluciones el mismo día. Sin embargo, si necesita preparar soluciones madre con antelación, le recomendamos que almacene la solución como alícuotas en viales herméticamente cerrados a -20°C. Por lo general, podrán utilizarse durante un mes. Antes de su uso, y antes de abrir el vial, le recomendamos que deje que el producto se equilibre a temperatura ambiente durante al menos 1 hora. ¿Necesita más consejos sobre solubilidad, uso y manipulación? Visite nuestra página de preguntas frecuentes (FAQ) para obtener más información.

Pureza

≥99%

Nombres e identificadores

• Pubchem Sid: 488184177
• Pubchem Sid Url: https://pubchem.ncbi.nlm.nih.gov/substance/488184177
• Sonrisas canónicas: CC1=C(C(=CC=C1)C(C)C2=CN=CN2)C.Cl
• IUPAC Name: 5-[1-(2,3-dimethylphenyl)ethyl]-1H-imidazole;hydrochloride
• InChIKey: VPNGEIHDPSLNMU-UHFFFAOYSA-N
• INCHI: 1S/C13H16N2.ClH/c1-9-5-4-6-12(10(9)2)11(3)13-7-14-8-15-13;/h4-8,11H,1-3H3,(H,14,15);1H
• Isómeros SMILES: CC1=C(C(=CC=C1)C(C)C2=CN=CN2)C.Cl
• Peso molecular: 236.74
• Reaxy-Rn: 5362300
• Reaxys-RN_link_address: https://www.reaxys.com/reaxys/secured/hopinto.do?context=S&query=IDE.XRN=5362300&ln=

Taxonomic Classification

Taxonomy Tree

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

• Kingdom: Organic compounds
• Superclass: Benzenoids
• Clase: Benzene and substituted derivatives
• Subclass: Xylenes
• Intermediate Tree Nodes: Not available
• Direct Parent: o-Xylenes
• Alternative Parents: Imidazoles Heteroaromatic compounds Azacyclic compounds Organopnictogen compounds Organonitrogen compounds Hydrochlorides Hydrocarbon derivatives
• Molecular Framework: Aromatic heteromonocyclic compounds
• Substituents: O-xylene - Heteroaromatic compound - Imidazole - Azole - Azacycle - Organoheterocyclic compound - Organic nitrogen compound - Organopnictogen compound - Hydrocarbon derivative - Hydrochloride - Organonitrogen compound - Aromatic heteromonocyclic compound
• Descripción: This compound belongs to the class of organic compounds known as o-xylenes. These are aromatic compounds that contain a o-xylene moiety, which is a monocyclic benzene carrying exactly two methyl groups at the 1- and 2-positions.
• External Descriptors: hydrochloride

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

Objetivos asociados (humanos)

TDP1 Tchem Tyrosyl-DNA phosphodiesterase 1 (345557 Activities)

Discover Target: TDP1

Activity Type	Relation	Activity value	Units	Action Type	Journal	PubMed Id	doi	Assay Aladdin ID

Objetivos asociados (no humanos)

Rattus norvegicus (775804 Activities)

Explore this target

Activity Type	Relation	Activity value	Units	Action Type	Journal	PubMed Id	doi	Assay Aladdin ID

rep Replicase polyprotein 1ab (378 Activities)

Discover Target: rep

Activity Type	Relation	Activity value	Units	Action Type	Journal	PubMed Id	doi	Assay Aladdin ID

Adra1b Adrenergic receptor alpha-1 (5652 Activities)

Discover Target: Adra1b

Activity Type	Relation	Activity value	Units	Action Type	Journal	PubMed Id	doi	Assay Aladdin ID

Adra2c Adrenergic receptor alpha-2 (3313 Activities)

Discover Target: Adra2c

Activity Type	Relation	Activity value	Units	Action Type	Journal	PubMed Id	doi	Assay Aladdin ID

Mecanismos de acción

Propiedades químicas y físicas

• Solubilidad: DMSO 12 mg/mL Water 47 mg/mL Ethanol 47 mg/mL
• Sensibilidad: Hygroscopic
• Punto de fusión (°C): 179 °C
• Peso molecular: 236.740 g/mol
• Hydrogen Bond Donor Count: 2
• Hydrogen Bond Acceptor Count: 1
• Rotatable Bond Count: 2
• Exact Mass: 236.108 Da
• Monoisotopic Mass: 236.108 Da
• Topological Polar Surface Area: 28.700 Ų
• Heavy Atom Count: 16
• Formal Charge: 0
• Complexity: 205.000
• 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

XLogP3