Evenamide - ≥97% , Sodium channel alpha subunit blocker, CAS No.1092977-61-1, Sodium channel alpha subunit blocker

CAS: 1092977-61-1 Cat. No.: E650151 分子式: C₁₆H₂₆N₂O₂ 分子量: 278.39 PubChem CID: 25105689

グレード＆純度 ≥97%

Synonyms

HY-17612 | Evenamide | 2-((3-Butoxyphenethyl)amino)-N,N-dimethylacetamide | DTXSID101032897 | F50592 | Evenamide [INN] | US9051240, 2-[2-(3-Butoxyphenyl)-ethylamino]-N,N-dimethylacetamide | Q21098995 | UNII-ON5S6N53JS | AS-48527 | Acetamide, 2-((2-(3-buto

Storage

Protected from light,Store at -20°C

Shipped In

Ice chest + Ice pads

概要

Evenamide (NW-3509) is an orally available voltage-gated sodium channel (VGSC) blocker (Ki=0.4 µM) for the research of schizophrenia. Evenamide shows efficacy in a broad spectrum of rodent models of psychosis, mania, depression, and aggressiveness.

仕様

同義語

HY-17612 | Evenamide | 2-((3-Butoxyphenethyl)amino)-N,N-dimethylacetamide | DTXSID101032897 | F50592 | Evenamide [INN] | US9051240, 2-[2-(3-Butoxyphenyl)-ethylamino]-N,N-dimethylacetamide | Q21098995 | UNII-ON5S6N53JS | AS-48527 | Acetamide, 2-((2-(3-buto

仕様と純度

≥97%

生化学的・生理学的メカニズム

Evenamide (NW-3509) is an orally available voltage-gated sodium channel (VGSC) blocker ( K i =0.4 µM) for the research of schizophrenia. Evenamide shows efficacy in a broad spectrum of rodent models of psychosis, mania, depression, and aggressiveness

保管条件

Protected from light,Store at -20°C

入荷

Ice chest + Ice pads

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

BLOCKER

作用メカニズム

Sodium channel alpha subunit blocker

純度

≥97%

製品の性質

ALogP

2.5

名前と識別子

パブケム・シド

528764434

カノニカル・スマイル

CCCCOC1=CC=CC(=C1)CCNCC(=O)N(C)C

IUPAC Name

2-[2-(3-butoxyphenyl)ethylamino]-N,N-dimethylacetamide

InChIKey

GRHBODILPPXVKN-UHFFFAOYSA-N

INCHI

1S/C16H26N2O2/c1-4-5-11-20-15-8-6-7-14(12-15)9-10-17-13-16(19)18(2)3/h6-8,12,17H,4-5,9-11,13H2,1-3H3

異性体SMILES

CCCCOC1=CC=CC(=C1)CCNCC(=O)N(C)C

代替CAS番号

1092977-61-1

PubChem CID

25105689

分子量

278.39

Taxonomic Classification

Taxonomy Tree

• Kingdom Organic compounds
  • Superclass Organic acids and derivatives
    • 分類 Carboxylic acids and derivatives
      • Subclass Amino acids, peptides, and analogues
        • Level5 Amino acids and derivatives
          • Level6 Alpha amino acids and derivatives
            • Level7 Alpha amino acid amides

• Kingdom: Organic compounds
• Superclass: Organic acids and derivatives
• 分類: Carboxylic acids and derivatives
• Subclass: Amino acids, peptides, and analogues
• Intermediate Tree Nodes: Amino acids and derivatives - Alpha amino acids and derivatives
• Direct Parent: Alpha amino acid amides
• Alternative Parents: Phenethylamines Phenoxy compounds Phenol ethers Aralkylamines Alkyl aryl ethers Tertiary carboxylic acid amides Dialkylamines Organic oxides Hydrocarbon derivatives Carbonyl compounds
• Molecular Framework: Aromatic homomonocyclic compounds
• Substituents: Alpha-amino acid amide - Phenethylamine - Phenoxy compound - Phenol ether - Alkyl aryl ether - Aralkylamine - Benzenoid - Monocyclic benzene moiety - Tertiary carboxylic acid amide - Carboxamide group - Secondary amine - Ether - Secondary aliphatic amine - Organic oxide - Organic oxygen compound - Organooxygen compound - Organonitrogen compound - Carbonyl group - Amine - Organic nitrogen compound - Hydrocarbon derivative - Aromatic homomonocyclic compound
• 説明: This compound belongs to the class of organic compounds known as alpha amino acid amides. These are amide derivatives of alpha amino acids.
• 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）

MAOB Tclin Monoamine oxidase B (8835 Activities)

Discover Target: MAOB

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

CYP2D6 Tclin Cytochrome P450 2D6 (33882 Activities)

Discover Target: CYP2D6

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: DMSO : 100 mg/mL (359.21 mM; Need ultrasonic)
• 感度: Light sensitive
• 分子量: 278.390 g/mol
• XLogP3: 2.500
• Hydrogen Bond Donor Count: 1
• Hydrogen Bond Acceptor Count: 3
• Rotatable Bond Count: 9
• Exact Mass: 278.199 Da
• Monoisotopic Mass: 278.199 Da
• Topological Polar Surface Area: 41.600 Ų
• Heavy Atom Count: 20
• Formal Charge: 0
• Complexity: 269.000
• 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: 1