Antazoline Hydrochloride - ≥98% , CAS No.2508-72-7

CAS: 2508-72-7 Cat. No.: A124055 Summenformel: C₁₇H₁₉N₃·HCl Molekulargewicht: 301.82 Beilstein Registry Number: 25(4)2006 EG-Nummer: 219-719-8

GRADE & PURITY ≥98%

Synonyms

2-(N-Benzylanilino)methyl-2-imidazoline, hydrochloride | 2-(N-Benzylanilinomethyl)-2-imidazoline hydrochloride | Antazoline HCl | ANTAZOLINE HYDROCHLORIDE [VANDF] | Histazine | NCGC00016613-10 | AS-74198 | Q27278115 | Tox21_110524_1 | 2-IMIDAZOLINE, 2-((N

Storage

Store at -20°C

Shipped In

Ice chest + Ice pads

Übersicht

Imidazoline agonist; more potent than efaroxan in inducing insulin release from β cells; H1 histamine receptor antagonist.
Imidazoline binding site ligand and an antihistamine

Specifications

Synonyme

2-(N-Benzylanilino)methyl-2-imidazoline, hydrochloride | 2-(N-Benzylanilinomethyl)-2-imidazoline hydrochloride | Antazoline HCl | ANTAZOLINE HYDROCHLORIDE [VANDF] | Histazine | NCGC00016613-10 | AS-74198 | Q27278115 | Tox21_110524_1 | 2-IMIDAZOLINE, 2-((N

Spezifikationen & Reinheit

≥98%

Biochemische und physiologische Mechanismen

Imidazoline binding site ligand; a potent inducer of insulin secretion in rat pancreas. Also an antihistamine.

Storage

Store at -20°C

Verschickt in

Ice chest + Ice pads

Dieses Produkt erfordert Kühlkettenversand. Grundversand und andere Economy-Optionen sind nicht verfügbar.

Reinheit

≥98%

Namen und Kennungen

Pubchem Sid

488182375

Pubchem Sid Url

https://pubchem.ncbi.nlm.nih.gov/substance/488182375

Kanonisches Lächeln

C1CN=C(N1)CN(CC2=CC=CC=C2)C3=CC=CC=C3.Cl

IUPAC Name

N-benzyl-N-(4,5-dihydro-1H-imidazol-2-ylmethyl)aniline;hydrochloride

InChIKey

SWKDMSRRIBZZAY-UHFFFAOYSA-N

INCHI

1S/C17H19N3.ClH/c1-3-7-15(8-4-1)13-20(14-17-18-11-12-19-17)16-9-5-2-6-10-16;/h1-10H,11-14H2,(H,18,19);1H

Isomere SMILES

C1CN=C(N1)CN(CC2=CC=CC=C2)C3=CC=CC=C3.Cl

WGK Deutschland

3

RTECS

NJ2150000

Molekulargewicht

301.82

Beilstein

25(4)2006

Reaxy-Rn

3747947

Reaxys-RN_link_address

https://www.reaxys.com/reaxys/secured/hopinto.do?context=S&query=IDE.XRN=3747947&ln=

Taxonomic Classification

Taxonomy Tree

• Kingdom Organic compounds
  • Superclass Benzenoids
    • Klasse Benzene and substituted derivatives
      • Subclass Phenylmethylamines

• Kingdom: Organic compounds
• Superclass: Benzenoids
• Klasse: Benzene and substituted derivatives
• Subclass: Phenylmethylamines
• Intermediate Tree Nodes: Not available
• Direct Parent: Phenylbenzamines
• Alternative Parents: Dialkylarylamines Benzylamines Aniline and substituted anilines Aralkylamines Imidolactams Imidazolines Propargyl-type 1,3-dipolar organic compounds Carboximidamides Carboxamidines Azacyclic compounds Organopnictogen compounds Hydrochlorides Hydrocarbon derivatives
• Molecular Framework: Aromatic heteromonocyclic compounds
• Substituents: Phenylbenzamine - Benzylamine - Tertiary aliphatic/aromatic amine - Aniline or substituted anilines - Dialkylarylamine - Aralkylamine - Imidolactam - 2-imidazoline - Tertiary amine - Amidine - Carboxylic acid amidine - Azacycle - Carboximidamide - Propargyl-type 1,3-dipolar organic compound - Organic 1,3-dipolar compound - Organoheterocyclic compound - Hydrocarbon derivative - Organic nitrogen compound - Amine - Organopnictogen compound - Hydrochloride - Organonitrogen compound - Aromatic heteromonocyclic compound
• Beschreibung: This compound belongs to the class of organic compounds known as phenylbenzamines. These are aromatic compounds consisting of a benzyl group that is N-linked to a benzamine.
• 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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CACNA1H Tclin Voltage-gated T-type calcium channel alpha-1H subunit (1913 Activities)

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HEK293 (82097 Activities)

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HIF1A Tchem Hypoxia-inducible factor 1 alpha (6027 Activities)

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SMAD3 Tchem Mothers against decapentaplegic homolog 3 (68039 Activities)

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GMNN Tbio Geminin (128009 Activities)

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Galc Galactocerebrosidase (11 Activities)

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Plasmodium falciparum (966862 Activities)

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Taar1 Trace amine-associated receptor 1 (899 Activities)

Discover Target: Taar1

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Wirkungsmechanismen

Chemische und physikalische Eigenschaften

• Löslichkeit: Solvent:water, Max Conc. mg/mL: None, Max Conc. mM: 100
• Schmelzpunkt (°C): 238°C
• Molekulargewicht: 301.800 g/mol
• Hydrogen Bond Donor Count: 2
• Hydrogen Bond Acceptor Count: 2
• Rotatable Bond Count: 5
• Exact Mass: 301.135 Da
• Monoisotopic Mass: 301.135 Da
• Topological Polar Surface Area: 27.600 Ų
• Heavy Atom Count: 21
• Formal Charge: 0
• Complexity: 314.000
• 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