Benzydamine HCl - 10mM in DMSO , Cyclooxygenase inhibitor, CAS No.132-69-4, Cyclooxygenase inhibitor

CAS: 132-69-4 Cat. No.: B421249 Summenformel: C₁₉H₂₃N₃O·HCl Molekulargewicht: 345.87 EG-Nummer: 205-076-0

QUALITÄT & REINHEIT 10mM in DMSO

Synonyms

AF 864 | Benzydamine (hydrochloride) | Benzydamine HCl | s4165 | 1-Propanamine, N,N-dimethyl-3-((1-(phenylmethyl)-1H-indazol-3-yl)oxy)-, hydrochloride | BENZYDAMINE HYDROCHLORIDE [USAN] | HY-30235A | NCGC00016397-04 | Not available;Benzydamine HCl | NSC75

Storage

Store at -80°C

Shipped In

Dry ice packs + Cold packs

Übersicht

Benzydamine hydrochloride has anti-inflammatory, analgesic, antipyretic and local anesthetic activity

Spezifikationen

Synonyme

AF 864 | Benzydamine (hydrochloride) | Benzydamine HCl | s4165 | 1-Propanamine, N,N-dimethyl-3-((1-(phenylmethyl)-1H-indazol-3-yl)oxy)-, hydrochloride | BENZYDAMINE HYDROCHLORIDE [USAN] | HY-30235A | NCGC00016397-04 | Not available;Benzydamine HCl | NSC75

Spezifikationen & Reinheit

10mM in DMSO

Biochemische und physiologische Mechanismen

Prostaglandin synthetase inhibitor. Locally-acting NSAID. Shows analgesic and antipyretic effects in vivo. Orally active.

Storage

Store at -80°C

Verschickt in

Dry ice packs + Cold packs

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

Aktionsart

INHIBITOR

Mechanismus der Wirkung

Cyclooxygenase inhibitor

Namen und Kennungen

Pubchem Sid

528773914

Kanonisches Lächeln

CN(C)CCCOC1=NN(C2=CC=CC=C21)CC3=CC=CC=C3.Cl

IUPAC Name

3-(1-benzylindazol-3-yl)oxy-N,N-dimethylpropan-1-amine;hydrochloride

InChIKey

HNNIWKQLJSNAEQ-UHFFFAOYSA-N

INCHI

1S/C19H23N3O.ClH/c1-21(2)13-8-14-23-19-17-11-6-7-12-18(17)22(20-19)15-16-9-4-3-5-10-16;/h3-7,9-12H,8,13-15H2,1-2H3;1H

Isomere SMILES

CN(C)CCCOC1=NN(C2=CC=CC=C21)CC3=CC=CC=C3.Cl

WGK Deutschland

3

RTECS

NK7875000

Alternative CAS-Nummer

642-72-8

Molekulargewicht

345.87

Reaxy-Rn

4282836

Reaxys-RN_link_address

https://www.reaxys.com/reaxys/secured/hopinto.do?context=S&query=IDE.XRN=4282836&ln=

Taxonomic Classification

Taxonomy Tree

• Kingdom Organic compounds
  • Superclass Organoheterocyclic compounds
    • Klasse Benzopyrazoles
      • Subclass Indazoles

• Kingdom: Organic compounds
• Superclass: Organoheterocyclic compounds
• Klasse: Benzopyrazoles
• Subclass: Indazoles
• Intermediate Tree Nodes: Not available
• Direct Parent: Indazoles
• Alternative Parents: Alkyl aryl ethers Benzene and substituted derivatives Pyrazoles Heteroaromatic compounds Trialkylamines Azacyclic compounds Organopnictogen compounds Hydrochlorides Hydrocarbon derivatives
• Molecular Framework: Aromatic heteropolycyclic compounds
• Substituents: Benzopyrazole - Indazole - Alkyl aryl ether - Monocyclic benzene moiety - Benzenoid - Azole - Pyrazole - Heteroaromatic compound - Tertiary aliphatic amine - Tertiary amine - Ether - Azacycle - Amine - Organooxygen compound - Organonitrogen compound - Hydrocarbon derivative - Organopnictogen compound - Organic oxygen compound - Organic nitrogen compound - Hydrochloride - Aromatic heteropolycyclic compound
• Beschreibung: This compound belongs to the class of organic compounds known as indazoles. These are compounds containing an indazole, which is structurally characterized by a pyrazole fused to a benzene.
• 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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GLP1R Tclin Glucagon-like peptide 1 receptor (111429 Activities)

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TDP1 Tchem Tyrosyl-DNA phosphodiesterase 1 (345557 Activities)

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CBX1 Tbio Chromobox protein homolog 1 (92434 Activities)

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IDH1 Tclin Isocitrate dehydrogenase [NADP] cytoplasmic (40980 Activities)

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rep Replicase polyprotein 1ab (378 Activities)

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fba Putative fructose-1,6-bisphosphate aldolase (15559 Activities)

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Wirkungsmechanismen

Chemische und physikalische Eigenschaften

• Empfindlichkeit: Heat sensitive
• Schmelzpunkt (°C): 156-161°C
• Molekulargewicht: 345.900 g/mol
• Hydrogen Bond Donor Count: 1
• Hydrogen Bond Acceptor Count: 3
• Rotatable Bond Count: 7
• Exact Mass: 345.161 Da
• Monoisotopic Mass: 345.161 Da
• Topological Polar Surface Area: 30.300 Ų
• Heavy Atom Count: 24
• Formal Charge: 0
• Complexity: 344.000
• 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