3,4-Diaminopyridine - Moligand™, ≥98% , Voltage-gated potassium channel blocker, CAS No.54-96-6, Voltage-gated potassium channel blocker

CAS: 54-96-6 Cat. No.: D154393 Summenformel: C₅H₇N₃ Molekulargewicht: 109.13 Beilstein Registry Number: 110232 EG-Nummer: 200-220-9

GRADE & PURITY Moligand™, ≥98%

Synonyms

BP-12781 | Tox21_112555 | amifampridina | Amifampridine [USAN:INN:BAN] | Amifampridine [INN] | CHEBI:135948 | EINECS 200-220-9 | Ruzurgi | STK503647 | AMIFAMPRIDINE (MART.) | D10228 | SC10 | AM20070030 | SCHEMBL21273 | Amifampridine (USAN/INN) | AMIFAMPRI

Storage

Argon charged,Room temperature

Shipped In

Normal

Specifications

Synonyme

BP-12781 | Tox21_112555 | amifampridina | Amifampridine [USAN:INN:BAN] | Amifampridine [INN] | CHEBI:135948 | EINECS 200-220-9 | Ruzurgi | STK503647 | AMIFAMPRIDINE (MART.) | D10228 | SC10 | AM20070030 | SCHEMBL21273 | Amifampridine (USAN/INN) | AMIFAMPRI

Spezifikationen & Reinheit

Moligand™, ≥98%

Storage

Argon charged,Room temperature

Verschickt in

Normal

Note

Moligand™

Aktionsart

BLOCKER

Mechanismus der Wirkung

Voltage-gated potassium channel blocker

Reinheit

≥98%

Produkteigenschaften

• ALogP: -0.5

Namen und Kennungen

• Pubchem Sid: 488179959
• Pubchem Sid Url: https://pubchem.ncbi.nlm.nih.gov/substance/488179959
• Kanonisches Lächeln: C1=CN=CC(=C1N)N
• IUPAC Name: pyridine-3,4-diamine
• InChIKey: OYTKINVCDFNREN-UHFFFAOYSA-N
• INCHI: 1S/C5H7N3/c6-4-1-2-8-3-5(4)7/h1-3H,7H2,(H2,6,8)
• Isomere SMILES: C1=CN=CC(=C1N)N
• WGK Deutschland: 3
• RTECS: US7600000
• UN-Nummer: 2811
• Verpackungsgruppe: II
• Molekulargewicht: 109.13
• Beilstein: 110232
• Reaxy-Rn: 110232
• Reaxys-RN_link_address: https://www.reaxys.com/reaxys/secured/hopinto.do?context=S&query=IDE.XRN=110232&ln=

Taxonomic Classification

Taxonomy Tree

• Kingdom Organic compounds
  • Superclass Organoheterocyclic compounds
    • Klasse Pyridines and derivatives
      • Subclass Aminopyridines and derivatives

• Kingdom: Organic compounds
• Superclass: Organoheterocyclic compounds
• Klasse: Pyridines and derivatives
• Subclass: Aminopyridines and derivatives
• Intermediate Tree Nodes: Not available
• Direct Parent: Aminopyridines and derivatives
• Alternative Parents: Heteroaromatic compounds Azacyclic compounds Primary amines Organopnictogen compounds Hydrocarbon derivatives
• Molecular Framework: Aromatic heteromonocyclic compounds
• Substituents: Aminopyridine - Heteroaromatic compound - Azacycle - Organic nitrogen compound - Organopnictogen compound - Hydrocarbon derivative - Primary amine - Organonitrogen compound - Amine - Aromatic heteromonocyclic compound
• Beschreibung: This compound belongs to the class of organic compounds known as aminopyridines and derivatives. These are organic heterocyclic compounds containing an amino group attached to a pyridine ring.
• 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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F2 Tclin Thrombin (11687 Activities)

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ESR1 Tclin Estrogen receptor alpha (17718 Activities)

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PGR Tclin Progesterone receptor (8562 Activities)

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CHRM2 Tclin Muscarinic acetylcholine receptor M2 (10671 Activities)

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HTR1A Tclin Serotonin 1a (5-HT1a) receptor (14969 Activities)

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ADRA2A Tclin Alpha-2a adrenergic receptor (9450 Activities)

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AR Tclin Androgen Receptor (11781 Activities)

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CHRM1 Tclin Muscarinic acetylcholine receptor M1 (12690 Activities)

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GABRA1 Tclin GABA receptor alpha-1 subunit (399 Activities)

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MAOA Tclin Monoamine oxidase A (11911 Activities)

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DRD1 Tclin Dopamine D1 receptor (9720 Activities)

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ACHE Tclin Acetylcholinesterase (18204 Activities)

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PTGS1 Tclin Cyclooxygenase-1 (9233 Activities)

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SLC6A2 Tclin Norepinephrine transporter (10102 Activities)

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ADORA1 Tclin Adenosine A1 receptor (17603 Activities)

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SLC6A4 Tclin Serotonin transporter (12625 Activities)

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ADRA1A Tclin Alpha-1a adrenergic receptor (8359 Activities)

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OPRM1 Tclin Mu opioid receptor (19785 Activities)

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DRD3 Tclin Dopamine D3 receptor (14368 Activities)

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SLC6A3 Tclin Dopamine transporter (10535 Activities)

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PTH1R Tclin Parathyroid hormone receptor (47172 Activities)

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KCNH2 Tclin HERG (29587 Activities)

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PDE3A Tclin Phosphodiesterase 3A (3309 Activities)

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HTR2B Tclin Serotonin 2b (5-HT2b) receptor (10323 Activities)

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TBXA2R Tclin Thromboxane A2 receptor (5717 Activities)

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PDE4A Tclin Phosphodiesterase 4A (1943 Activities)

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ADORA3 Tchem Adenosine A3 receptor (15931 Activities)

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HRH3 Tclin Histamine H3 receptor (10389 Activities)

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KDR Tclin Vascular endothelial growth factor receptor 2 (20924 Activities)

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GLP1R Tclin Glucagon-like peptide 1 receptor (111429 Activities)

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EHMT2 Tchem Histone-lysine N-methyltransferase, H3 lysine-9 specific 3 (93046 Activities)

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ERG Tbio Transcriptional regulator ERG (5589 Activities)

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GMNN Tbio Geminin (128009 Activities)

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GLS Tchem Glutaminase kidney isoform, mitochondrial (16997 Activities)

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POU2F1 Tbio POU domain, class 2, transcription factor 1 (93 Activities)

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ampC Beta-lactamase AmpC (62480 Activities)

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Hdac6 Histone deacetylase 6 (222 Activities)

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Slc5a7 Choline transporter (45 Activities)

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Rattus norvegicus (775804 Activities)

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rep Replicase polyprotein 1ab (378 Activities)

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SARS-CoV-2 (38078 Activities)

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Wirkungsmechanismen

Chemische und physikalische Eigenschaften

• Löslichkeit: Soluble in water (24 mg/ml at 20°C), alcohol. Slightly soluble in ether.
• Empfindlichkeit: air sensitive
• Flammpunkt (°F): 240℃
• Flammpunkt (°C): 240℃
• Schmelzpunkt (°C): 217-220°C
• Molekulargewicht: 109.130 g/mol
• XLogP3: -0.500
• Hydrogen Bond Donor Count: 2
• Hydrogen Bond Acceptor Count: 3
• Rotatable Bond Count: 0
• Exact Mass: 109.064 Da
• Monoisotopic Mass: 109.064 Da
• Topological Polar Surface Area: 64.900 Ų
• Heavy Atom Count: 8
• Formal Charge: 0
• Complexity: 74.100
• 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

Referenzen

1. Qiqi Xu, Yuetong Zhang, Zulu Yang, Guohui Jiang, Mingzhu Lv, Huan Wang, Chenghui Liu, Jiani Xie, Chengyan Wang, Kun Guo, Zhanjun Gu, Yuan Yong.  (2022)  Tumor microenvironment-activated single-atom platinum nanozyme with H2O2 self-supplement and O2-evolving for tumor-specific cascade catalysis chemodynamic and chemoradiotherapy.  Theranostics,      [PMID:35836808] [10.7150/thno.73039]

2. Lu Zhang, Tianping Wang, Weiwen Wang, Xiangnan Wang, Zhen Zhang, Chong Cheng, Xikui Liu.  (2021)  Modulator-Assisted Photosynthesis: Green and Powerful Approach towards Superstructured π−Conjugated Covalent Organic Frameworks with Enhanced Electrochemical Performances.  ChemPhotoChem,  6  (3): (e202100229).  [PMID:] [10.1002/cptc.202100229]

3. Qiqi Xu, Yusheng Hua, Yuetong Zhang, Mingzhu Lv, Huan Wang, Yang Pi, Jiani Xie, Chengyan Wang, Yuan Yong.  (2021)  A Biofilm Microenvironment-Activated Single-Atom Iron Nanozyme with NIR-Controllable Nanocatalytic Activities for Synergetic Bacteria-Infected Wound Therapy.  Advanced Healthcare Materials,  10  (22): (2101374).  [PMID:34617410] [10.1002/adhm.202101374]

Häufig gestellte Fragen

What is Moligand??

Moligand? is one of Aladdin Scientific's premium product lines, formulated for high-purity applications across multiple workflows. Compared to standard grades in the same workflow, Moligand? products typically offer tighter specifications, more rigorous QC, and stronger lot-to-lot consistency.

How should this product be stored?

Store at room temperature under argon. It is supplied under an argon blanket; reseal under inert gas after each use.

How is this product shipped?

This product ships under standard ambient conditions. No temperature-controlled packaging is required.

What are the CAS number, molecular formula and molecular weight?

The CAS Number is 54-96-6, the molecular formula is C5H7N3, and the molecular weight is 109.13 g/mol. InChIKey OYTKINVCDFNREN-UHFFFAOYSA-N.

What is the purity of this product?

This product is supplied at ≥98% purity (chemical assay). Lot-specific values are stated on the Certificate of Analysis.

What documentation is provided?

Available product documentation, including Certificates of Analysis (COA), Safety Data Sheets (SDS), and specification sheets, is shown in the product document area. Document availability and access follow the current site policy.