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

グレード＆純度 ≥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|N,N'-bis(diphenylmethyl)ethane-1,2-diamine dihydrochloride|AMN082 2HCl|C28H28N2.2HCl|N,N'-Dibenzhydrylethane-1,2-diamine dihydrochloride|N,N'-dibenzhydrylethane-1,2-diamine;dihydrochloride|AMN082|AMN 082 (Free base)|N,N'-bis(diphenylmethyl)ethane-1,2-bis(aminium) dichloride|N1,N2-Dibenzhydrylethane-1,2-diamine dihydrochloride|AMN082 DIHYDROCHLORIDE|4-nitrophenyl-hydrazine|AMN 082 dihydrochloride|N(1),N(2)-bis(diphenylmethyl)ethane-1,2-bis(aminium) dichloride

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

仕様

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 | N,N'-bis(diphenylmethyl)ethane-1,2-diamine dihydrochloride | AMN082 2HCl | C28H28N もっと見る

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

パブケム・シド・ウル

https://pubchem.ncbi.nlm.nih.gov/substance/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

関連ターゲット（人間）

TSHR Tclin Thyroid stimulating hormone receptor (29986 Activities)

Discover Target: TSHR

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ALOX15B Tchem Arachidonate 15-lipoxygenase, type II (7244 Activities)

Discover Target: ALOX15B

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

ALOX15 Tchem Arachidonate 15-lipoxygenase (7108 Activities)

Discover Target: ALOX15

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

CYP3A4 Tclin Cytochrome P450 3A4 (53859 Activities)

Discover Target: CYP3A4

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

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

Discover Target: RUNX1

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

関連ターゲット（非人間）

lef Anthrax lethal factor (7585 Activities)

Discover Target: lef

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rep Replicase polyprotein 1ab (378 Activities)

Discover Target: rep

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Rorc Nuclear receptor ROR-gamma (89407 Activities)

Discover Target: Rorc

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

ffp 4'-phosphopantetheinyl transferase ffp (24982 Activities)

Discover Target: ffp

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

FTL Ferritin light chain (43324 Activities)

Discover Target: FTL

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

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