GRADE & PURITY ≥98%

Synonyms

BCP31637 | BD 1063 dihydrochloride, >=98% (HPLC) | DTXSID00469537 | BD1063 dhydrochloride | BB 0248085 | HMS1379M06 | 1-[2-(3,4-dichlorophenyl)ethyl]-4-methylpiperazine;dihydrochloride | BD1063 (dhydrochloride) | BD 1063 Dihydrochloride | SR-01000597944-1

Storage

Store at -20°C,Argon charged

Shipped In

Ice chest + Ice pads

Descripción general

Application：

BD 1063 dihydrochloride has been used as a sigma-1 receptor (S1R) antagonist:

to study the in vitro and in vivo protective action of S1R against ferroptosis in hepatocellular carcinoma cells in a comparative evaluation of its anti-hyperalgesic action with that of the effects of N-(2-morpholin-4-yl-ethyl)-2-(1-naphthyloxy) acetamide (NMIN) in a chronic constriction injury model (CCI) to study the contribution of sigma receptors inhibition to the neuroprotective effects of memantine against amyloid-beta (Aβ)-induced neurotoxicity in SH-SY5Y cells

Specifications

Sinónimos

BCP31637 | BD 1063 dihydrochloride, >=98% (HPLC) | DTXSID00469537 | BD1063 dhydrochloride | BB 0248085 | HMS1379M06 | 1-[2-(3, 4-dichlorophenyl)ethyl]-4-methylpiperazine;dihydrochloride | BD1063 (dhydrochloride) | BD 1063 Dihydrochloride | SR-01000597944-1

Especificaciones y pureza

≥98%

Mecanismos bioquímicos y fisiológicos

σ1receptor antagonist, approximately 50-fold selective overσ2sites and ≥100-fold selective over opioid, PCP, muscarinic, dopamine, α1, α2, βadrenoceptor, 5-HT1and 5-HT2receptors. Prevents hyperlocomotion following cocaine administration in mice.BD 1063 is a

Condiciones de almacenamiento de almacenamiento

Store at -20°C, Argon charged

Enviado en

Ice chest + Ice pads

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

Tipo de acción

ANTAGONIST

Pureza

≥98%

Nombres e identificadores

• Sonrisas canónicas: CN1CCN(CC1)CCC2=CC(=C(C=C2)Cl)Cl.Cl.Cl
• IUPAC Name: 1-[2-(3,4-dichlorophenyl)ethyl]-4-methylpiperazine;dihydrochloride
• InChIKey: NXFDBTLQOARIMH-UHFFFAOYSA-N
• INCHI: 1S/C13H18Cl2N2.2ClH/c1-16-6-8-17(9-7-16)5-4-11-2-3-12(14)13(15)10-11;;/h2-3,10H,4-9H2,1H3;2*1H
• Isómeros SMILES: CN1CCN(CC1)CCC2=CC(=C(C=C2)Cl)Cl.Cl.Cl
• WGK Alemania: 3
• PubChem CID: 11617161
• Peso molecular: 346.12

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: Dichlorobenzenes N-methylpiperazines Aralkylamines Aryl chlorides Trialkylamines Azacyclic compounds Organochlorides Hydrochlorides Hydrocarbon derivatives
• Molecular Framework: Aromatic heteromonocyclic compounds
• Substituents: Phenethylamine - 1,2-dichlorobenzene - Chlorobenzene - Halobenzene - N-methylpiperazine - N-alkylpiperazine - Aralkylamine - Aryl chloride - Piperazine - 1,4-diazinane - Aryl halide - Tertiary aliphatic amine - Tertiary amine - Organoheterocyclic compound - Azacycle - Hydrocarbon derivative - Organonitrogen compound - Organochloride - Organohalogen compound - Organic nitrogen compound - Amine - Hydrochloride - 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

Objetivos asociados (no humanos)

Mus musculus (284745 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

Mecanismos de acción

Propiedades químicas y físicas

• Solubilidad: Solvent:water, Max Conc. mg/mL: 34.61, Max Conc. mM: 100；H2O: >15 mg/mL
• Sensibilidad: Moisture sensitive
• Punto de fusión (°C): >220°C (dec.)
• Peso molecular: 346.100 g/mol
• Hydrogen Bond Donor Count: 2
• Hydrogen Bond Acceptor Count: 2
• Rotatable Bond Count: 3
• Exact Mass: 346.035 Da
• Monoisotopic Mass: 344.038 Da
• Topological Polar Surface Area: 6.500 Ų
• Heavy Atom Count: 19
• Formal Charge: 0
• Complexity: 229.000
• 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: 3

XLogP3