Lazabemide hydrochloride - ≥98%(HPLC) , CAS No.103878-83-7

CAS: 103878-83-7 Cat. No.: L287023 Peso molecular: 236.1

GRADE & PURITY ≥98%(HPLC)

Synonyms

Lazabemide hydrochloride | Lazabemidehydrochloride | Tox21_112582_1 | Lazabemide (hydrochloride) | AKOS024457114 | LAZABEMIDE MONOHYDROCHLORIDE [MI] | N-(2-aminoethyl)-5-chloropyridine-2-carboxamide;hydrochloride | 2-Pyridinecarboxamide, N-(2-aminoethyl)-

Storage

Room temperature,Desiccated

Shipped In

Normal

Specifications

Sinónimos

Lazabemide hydrochloride | Lazabemidehydrochloride | Tox21_112582_1 | Lazabemide (hydrochloride) | AKOS024457114 | LAZABEMIDE MONOHYDROCHLORIDE [MI] | N-(2-aminoethyl)-5-chloropyridine-2-carboxamide;hydrochloride | 2-Pyridinecarboxamide, N-(2-aminoethyl)-

Especificaciones y pureza

≥98%(HPLC)

Mecanismos bioquímicos y fisiológicos

Selective, reversible monoamine oxidase B (MAO-B) inhibitor (IC50values are 0.03 and > 100μM for MAO-B and MAO-A respectively). Inhibits monoamine uptake at high concentrations (IC50values are 86, 123 and > 500μM for noradrenalin, serotonin and dopamine u

Condiciones de almacenamiento de almacenamiento

Room temperature, Desiccated

Enviado en

Normal

Tipo de acción

INHIBITOR

Pureza

≥98%(HPLC)

Nombres e identificadores

• Pubchem Sid: 504757539
• Pubchem Sid Url: https://pubchem.ncbi.nlm.nih.gov/substance/504757539
• Sonrisas canónicas: C1=CC(=NC=C1Cl)C(=O)NCCN.Cl
• IUPAC Name: N-(2-aminoethyl)-5-chloropyridine-2-carboxamide;hydrochloride
• InChIKey: JMFKTFLARGGXCC-UHFFFAOYSA-N
• INCHI: 1S/C8H10ClN3O.ClH/c9-6-1-2-7(12-5-6)8(13)11-4-3-10;/h1-2,5H,3-4,10H2,(H,11,13);1H
• Isómeros SMILES: C1=CC(=NC=C1Cl)C(=O)NCCN.Cl
• Peso molecular: 236.1
• Reaxy-Rn: 6668812
• Reaxys-RN_link_address: https://www.reaxys.com/reaxys/secured/hopinto.do?context=S&query=IDE.XRN=6668812&ln=

Taxonomic Classification

Taxonomy Tree

• Kingdom Organic compounds
  • Superclass Organoheterocyclic compounds
    • Clase Pyridines and derivatives
      • Subclass Pyridinecarboxylic acids and derivatives

• Kingdom: Organic compounds
• Superclass: Organoheterocyclic compounds
• Clase: Pyridines and derivatives
• Subclass: Pyridinecarboxylic acids and derivatives
• Intermediate Tree Nodes: Not available
• Direct Parent: Pyridinecarboxamides
• Alternative Parents: 2-heteroaryl carboxamides Aryl chlorides Heteroaromatic compounds Secondary carboxylic acid amides Amino acids and derivatives Azacyclic compounds Organopnictogen compounds Organooxygen compounds Organochlorides Organic oxides Monoalkylamines Hydrochlorides Hydrocarbon derivatives
• Molecular Framework: Aromatic heteromonocyclic compounds
• Substituents: Pyridinecarboxamide - 2-heteroaryl carboxamide - Aryl chloride - Aryl halide - Heteroaromatic compound - Amino acid or derivatives - Carboxamide group - Secondary carboxylic acid amide - Carboxylic acid derivative - Azacycle - Amine - Hydrochloride - Primary amine - Organooxygen compound - Organonitrogen compound - Organochloride - Organohalogen compound - Primary aliphatic amine - Hydrocarbon derivative - Organic oxide - Organopnictogen compound - Organic oxygen compound - Organic nitrogen compound - Aromatic heteromonocyclic compound
• Descripción: This compound belongs to the class of organic compounds known as pyridinecarboxamides. These are compounds containing a pyridine ring bearing a carboxamide.
• 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

Objetivos asociados (no humanos)

rep Replicase polyprotein 1ab (378 Activities)

Discover Target: rep

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

Mecanismos de acción

Propiedades químicas y físicas

• Solubilidad: Solvent:water, Max Conc. mg/mL: 23.61, Max Conc. mM: 100; Solvent:DMSO, Max Conc. mg/mL: 23.61, Max Conc. mM: 100
• Peso molecular: 236.100 g/mol
• Hydrogen Bond Donor Count: 3
• Hydrogen Bond Acceptor Count: 3
• Rotatable Bond Count: 3
• Exact Mass: 235.028 Da
• Monoisotopic Mass: 235.028 Da
• Topological Polar Surface Area: 68.000 Ų
• Heavy Atom Count: 14
• Formal Charge: 0
• Complexity: 177.000
• 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: 2

XLogP3