AMN082 free base - ≥98% , CAS No.83027-13-8

CAS: 83027-13-8 Cat. No.: A336629 分子式: C₂₈H₂₈N₂ 分子量: 392.54 PubChem CID: 11698390

GRADE & PURITY ≥98%

Synonyms

N,N'-dibenzhydryl-1,2-ethanediamine dihydrochloride | N,N/'-dibenzhydrylethane-1,2-diamine;dihydrochloride | N,N'-dibenzhydrylethylenediamine dihydrochloride | AMN 082 | N,N inverted exclamation marka-bis(diphenylmethyl)-1,2-ethanediamine, dihydrochloride

Storage

Store at 2-8°C,Protected from light,Desiccated

Shipped In

Wet ice

概要

AMN082 Dihydrochloride is a potent and selective agonist at mGluR-7, acting at an allosteric site. mGluR-7 is a metabotropic glutamate receptor 7. AMN082 has been shown to promote the proliferation and differentiation of neural progenitor cells.

Product description：

AMN082 free base, a selective, orally active, and brain penetrant mGluR7 agonist, directly activates receptor signaling via an allosteric site in the transmembrane domain. AMN082 free base potently inhibits cAMP accumulation and stimulates GTPγS binding (EC50 values, 64-290 nM) at transfected mammalian cells expressing mGluR7. AMN082 free base shows selectivity over other mGluR subtypes and selected ionotropic glutamate receptors. Antidepressant effects

Specifications

同義語

N,N'-dibenzhydryl-1,2-ethanediamine dihydrochloride | N,N/'-dibenzhydrylethane-1,2-diamine;dihydrochloride | N,N'-dibenzhydrylethylenediamine dihydrochloride | AMN 082 | N,N inverted exclamation marka-bis(diphenylmethyl)-1,2-ethanediamine, dihydrochloride

仕様と純度

≥98%

保管条件

Store at 2-8°C,Protected from light,Desiccated

入荷

Wet ice

この製品は冷冷この冷このこの製品の運送が必要です。地上およびその他の経済サービスは利用できません。

アクションタイプ

AGONIST

純度

≥98%

製品の性質

• pKa: pKₐ: 8.38

名前と識別子

• パブケム・シド: 508810310
• カノニカル・スマイル: C1=CC=C(C=C1)C(C2=CC=CC=C2)NCCNC(C3=CC=CC=C3)C4=CC=CC=C4.Cl.Cl
• IUPAC Name: N,N'-dibenzhydrylethane-1,2-diamine;dihydrochloride
• InChIKey: YRQCDCNQANSUPB-UHFFFAOYSA-N
• INCHI: 1S/C28H28N2.2ClH/c1-5-13-23(14-6-1)27(24-15-7-2-8-16-24)29-21-22-30-28(25-17-9-3-10-18-25)26-19-11-4-12-20-26;;/h1-20,27-30H,21-22H2;2*1H
• 異性体SMILES: C1=CC=C(C=C1)C(C2=CC=CC=C2)NCCNC(C3=CC=CC=C3)C4=CC=CC=C4.Cl.Cl
• WGKドイツ: 3
• PubChem CID: 11698390
• 分子量: 392.54

Taxonomic Classification

Taxonomy Tree

• Kingdom Organic compounds
  • Superclass Benzenoids
    • 分類 Benzene and substituted derivatives
      • Subclass Diphenylmethanes

• Kingdom: Organic compounds
• Superclass: Benzenoids
• 分類: Benzene and substituted derivatives
• Subclass: Diphenylmethanes
• Intermediate Tree Nodes: Not available
• Direct Parent: Diphenylmethanes
• Alternative Parents: Aralkylamines Dialkylamines Hydrochlorides Hydrocarbon derivatives
• Molecular Framework: Aromatic homomonocyclic compounds
• Substituents: Diphenylmethane - Aralkylamine - Secondary amine - Secondary aliphatic amine - Organic nitrogen compound - Hydrocarbon derivative - Hydrochloride - Organonitrogen compound - Amine - Aromatic homomonocyclic compound
• 説明: This compound belongs to the class of organic compounds known as diphenylmethanes. These are compounds containing a diphenylmethane moiety, which consists of a methane wherein two hydrogen atoms are replaced by two phenyl groups.
• 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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CYP3A4 Tclin Cytochrome P450 3A4 (53859 Activities)

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RUNX1 Tbio Runt-related transcription factor 1/Core-binding factor subunit beta (7867 Activities)

Discover Target: RUNX1

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Rorc Nuclear receptor ROR-gamma (89407 Activities)

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ffp 4'-phosphopantetheinyl transferase ffp (24982 Activities)

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FTL Ferritin light chain (43324 Activities)

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作用メカニズム

化学的性質と物理的性質

• 溶解度: Soluble in DMSO (10 mg/ml), 100% ethanol, methanol (10 mM), and water.
• 感度: light sensitive
• 沸点（°C）: 533.7° C at 760 mmHg (Predicted)
• 分子量: 465.500 g/mol
• Hydrogen Bond Donor Count: 4
• Hydrogen Bond Acceptor Count: 2
• Rotatable Bond Count: 9
• Exact Mass: 464.179 Da
• Monoisotopic Mass: 464.179 Da
• Topological Polar Surface Area: 24.100 Ų
• Heavy Atom Count: 32
• Formal Charge: 0
• Complexity: 362.000
• 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