Nicotinic hydrazide - ≥98% , CAS No.553-53-7

CAS: 553-53-7 Cat. No.: N109733 Fórmula: C₆H₇N₃O Peso molecular: 137.14 Beilstein Registry Number: 119299 Número CE: 209-041-0

GRADE & PURITY ≥98%

Synonyms

MFCD00006383 | Nicotinic acid hydrazide | HY-W012617 | Niazid | BB 0240607 | EN300-18499 | FT-0632378 | (3-Pyridylcarbonyl)hydrazine | Nicotinohydrazide | SY033050 | 3-Pyridylcarbonylhydrazine | F0001-1451 | NCGC00248790-01 | AF1LLO72TM | NICOTINIC ACID,

Storage

Store at 2-8°C,Argon charged

Shipped In

Wet ice

Visão geral

Nicotinic hydrazide dissolves in water at a concentration of 50 mg/ml to form a clear, colourless solution.

Nicotinic hydrazide is used in hydrazone library formation. It is used to study the oxidation of isonicotinic acid hydrazide (ionized) by horseradish peroxidase. Nicotinic hydrazide is an inhibitor of peroxidase enzyme. It forms solid metal complexes having strong biological activity

Specifications

Sinónimos

MFCD00006383 | Nicotinic acid hydrazide | HY-W012617 | Niazid | BB 0240607 | EN300-18499 | FT-0632378 | (3-Pyridylcarbonyl)hydrazine | Nicotinohydrazide | SY033050 | 3-Pyridylcarbonylhydrazine | F0001-1451 | NCGC00248790-01 | AF1LLO72TM | NICOTINIC ACID,

Especificações e pureza

≥98%

Mecanismos bioquímicos e fisiológicos

Nicotinic hydrazide is an inhibitor of peroxidase enzyme. It forms solid metal complexes having strong biological activity.

Condições de armazenamento de armazenamento

Store at 2-8°C,Argon charged

Enviado em

Wet ice

Este produto requer transporte de cadeia fria. Serviços terrestres e outros serviços econômicos não estão disponíveis.

Pureza

≥98%

Nomes e identificadores

• Pubchem Sid: 504752064
• Pubchem Sid Url: https://pubchem.ncbi.nlm.nih.gov/substance/504752064
• Sorrisos canónicos: C1=CC(=CN=C1)C(=O)NN
• IUPAC Name: pyridine-3-carbohydrazide
• InChIKey: KFUSANSHCADHNJ-UHFFFAOYSA-N
• INCHI: 1S/C6H7N3O/c7-9-6(10)5-2-1-3-8-4-5/h1-4H,7H2,(H,9,10)
• SMILES isoméricas: C1=CC(=CN=C1)C(=O)NN
• WGK Alemanha: 3
• RTECS: QT1750000
• Peso molecular: 137.14
• Beilstein: 119299
• Reaxy-Rn: 119299
• Reaxys-RN_link_address: https://www.reaxys.com/reaxys/secured/hopinto.do?context=S&query=IDE.XRN=119299&ln=

Taxonomic Classification

Taxonomy Tree

• Kingdom Organic compounds
  • Superclass Organoheterocyclic compounds
    • Classe Pyridines and derivatives
      • Subclass Pyridinecarboxylic acids and derivatives
        • Level5 Pyridinecarboxamides
          • Level6 Nicotinamides

• Kingdom: Organic compounds
• Superclass: Organoheterocyclic compounds
• Classe: Pyridines and derivatives
• Subclass: Pyridinecarboxylic acids and derivatives
• Intermediate Tree Nodes: Pyridinecarboxamides
• Direct Parent: Nicotinamides
• Alternative Parents: Heteroaromatic compounds Carboxylic acid hydrazides Azacyclic compounds Organopnictogen compounds Organooxygen compounds Organonitrogen compounds Organic oxides Hydrocarbon derivatives
• Molecular Framework: Aromatic heteromonocyclic compounds
• Substituents: Nicotinamide - Heteroaromatic compound - Carboxylic acid hydrazide - Azacycle - Carboxylic acid derivative - Organic nitrogen compound - Organic oxygen compound - Organopnictogen compound - Organic oxide - Hydrocarbon derivative - Organooxygen compound - Organonitrogen compound - Aromatic heteromonocyclic compound
• Descrição: This compound belongs to the class of organic compounds known as nicotinamides. These are heterocyclic aromatic compounds containing a pyridine ring substituted at position 3 by a carboxamide group.
• 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

Alvos associados (humanos)

HepG2 (196354 Activities)

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Alvos associados (não humanos)

Pseudomonas aeruginosa (123386 Activities)

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Klebsiella pneumoniae (43867 Activities)

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Mecanismos de ação

Propriedades químicas e físicas

• Solubilidade: Soluble in alcohol, water.
• Sensibilidade: Air sensitive
• Ponto de fusão (°C): 160-163°C
• Peso molecular: 137.140 g/mol
• XLogP3: -0.700
• Hydrogen Bond Donor Count: 2
• Hydrogen Bond Acceptor Count: 3
• Rotatable Bond Count: 1
• Exact Mass: 137.059 Da
• Monoisotopic Mass: 137.059 Da
• Topological Polar Surface Area: 68.000 Ų
• Heavy Atom Count: 10
• Formal Charge: 0
• Complexity: 126.000
• 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

Referências

1. Zuobing Xiao, Chengjing Wu, Xinyu Lu, Yunwei Niu, Peiran Yu, Xiaojie Ma.  (2023)  Substituent effect on controlled release of fragrant aldehydes from pH-triggered nicotinoylhydrazone-based precursors.  Molecular Systems Design & Engineering,  8  (6): (767-774).  [PMID:] [10.1039/D2ME00279E]

2. Min Xue, Yanchao Lü, Qingqing Sun, Kaiqiang Liu, Zhen Liu, Ping Sun.  (2015)  Ag(I)-Coordinated Supramolecular Metallogels Based on Schiff Base Ligands: Structural Characterization and Reversible Thixotropic Property.  CRYSTAL GROWTH & DESIGN,      [PMID:] [10.1021/acs.cgd.5b00952]