Detomidine HCl - Moligand™, ≥98% , CAS No.90038-01-0

CAS: 90038-01-0 Cat. No.: D129815 Summenformel: C₁₂H₁₄N₂·HCl Molekulargewicht: 222.71 EG-Nummer: 682-040-4

GRADE & PURITY Moligand™, ≥98%

Synonyms

Z2756516861 | 5-(2,3-Dimethylbenzyl)imidazole Hydrochloride | 5-[(2,3-dimethylphenyl)methyl]-1H-imidazole;hydrochloride | AKOS024464193 | 4-[(2,3-dimethylbenzyl)]imidazole hydrochloride | SW219456-1 | SY046831 | Detomidine HCl | NCGC00182057-03 | 4-(2,3-D

Storage

Store at 2-8°C,Desiccated

Shipped In

Wet ice

Übersicht

Detomidine HCl produce dose-dependent sedative and analgesic effects, mediatated by activation of α2 catecholamine receptors.
An α2-adrenergic agonist.

Specifications

Synonyme

Z2756516861 | 5-(2,3-Dimethylbenzyl)imidazole Hydrochloride | 5-[(2,3-dimethylphenyl)methyl]-1H-imidazole;hydrochloride | AKOS024464193 | 4-[(2,3-dimethylbenzyl)]imidazole hydrochloride | SW219456-1 | SY046831 | Detomidine HCl | NCGC00182057-03 | 4-(2,3-D

Spezifikationen & Reinheit

Moligand™, ≥98%

Biochemische und physiologische Mechanismen

Detomidine HCl is a nonnarcotic, synthetic alpha-2 adrenoreceptor agonist. Alpha2-adrenergic agonists produce dose-dependent sedative and analgesic effects, mediatated by activation of alpha-2 catecholamine receptors, thus inducing a negative feedback res

Storage

Store at 2-8°C,Desiccated

Verschickt in

Wet ice

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

Note

Moligand™

Aktionsart

AGONIST

Reinheit

≥98%

Namen und Kennungen

• Pubchem Sid: 488183391
• Pubchem Sid Url: https://pubchem.ncbi.nlm.nih.gov/substance/488183391
• Kanonisches Lächeln: CC1=C(C(=CC=C1)CC2=CN=CN2)C.Cl
• IUPAC Name: 5-[(2,3-dimethylphenyl)methyl]-1H-imidazole;hydrochloride
• InChIKey: OIWRDXKNDCJZSM-UHFFFAOYSA-N
• INCHI: 1S/C12H14N2.ClH/c1-9-4-3-5-11(10(9)2)6-12-7-13-8-14-12;/h3-5,7-8H,6H2,1-2H3,(H,13,14);1H
• Isomere SMILES: CC1=C(C(=CC=C1)CC2=CN=CN2)C.Cl
• Molekulargewicht: 222.71
• Reaxy-Rn: 10287321
• Reaxys-RN_link_address: https://www.reaxys.com/reaxys/secured/hopinto.do?context=S&query=IDE.XRN=10287321&ln=

Taxonomic Classification

Taxonomy Tree

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

• Kingdom: Organic compounds
• Superclass: Benzenoids
• Klasse: Benzene and substituted derivatives
• Subclass: Xylenes
• Intermediate Tree Nodes: Not available
• Direct Parent: o-Xylenes
• Alternative Parents: Imidazoles Heteroaromatic compounds Azacyclic compounds Organopnictogen compounds Organonitrogen compounds Hydrochlorides Hydrocarbon derivatives
• Molecular Framework: Aromatic heteromonocyclic compounds
• Substituents: O-xylene - Heteroaromatic compound - Imidazole - Azole - Azacycle - Organoheterocyclic compound - Organic nitrogen compound - Organopnictogen compound - Hydrocarbon derivative - Hydrochloride - Organonitrogen compound - Aromatic heteromonocyclic compound
• Beschreibung: This compound belongs to the class of organic compounds known as o-xylenes. These are aromatic compounds that contain a o-xylene moiety, which is a monocyclic benzene carrying exactly two methyl groups at the 1- and 2-positions.
• 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

Zugehörige Ziele (nicht menschlich)

rep Replicase polyprotein 1ab (378 Activities)

Discover Target: rep

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

Wirkungsmechanismen

Chemische und physikalische Eigenschaften

• Löslichkeit: Soluble in water, methanol, and DMSO.
• Empfindlichkeit: Moisture sensitive
• Schmelzpunkt (°C): 160°C
• Molekulargewicht: 222.710 g/mol
• Hydrogen Bond Donor Count: 2
• Hydrogen Bond Acceptor Count: 1
• Rotatable Bond Count: 2
• Exact Mass: 222.092 Da
• Monoisotopic Mass: 222.092 Da
• Topological Polar Surface Area: 28.700 Ų
• Heavy Atom Count: 15
• Formal Charge: 0
• Complexity: 181.000
• 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