GMQ hydrochloride - ≥98% , CAS No.5361-15-9

CAS: 5361-15-9 Cat. No.: G274891 Molecular Weight: 237.69 EC Number: 654-799-1 PubChem CID: 12253739

GRADE & PURITY ≥98%

Synonyms

SCHEMBL16908919 | 2-(4-methylquinazolin-2-yl)guanidine;hydrochloride | GMQ (hydrochloride) | 1-(4-methylquinazolin-2-yl)guanidine hydrochloride | AKOS024332817 | HY-107757 | NSC 403387 hydrochloride | 1-(4-methylquinazolin-2-yl)guanidinehydrochloride | N-

Storage

Store at -20°C

Shipped In

Ice chest + Ice pads

Overview

Store at +4°C. The product can be stored for up to 12 months.

Specifications

Synonyms

SCHEMBL16908919 | 2-(4-methylquinazolin-2-yl)guanidine;hydrochloride | GMQ (hydrochloride) | 1-(4-methylquinazolin-2-yl)guanidine hydrochloride | AKOS024332817 | HY-107757 | NSC 403387 hydrochloride | 1-(4-methylquinazolin-2-yl)guanidinehydrochloride | N-

Specifications & Purity

≥98%

Biochemical and Physiological Mechanisms

Selective ASIC3 channel activator at pH 7.4. Alters the pH dependence of ASIC1a and ASIC1b; does not affect the activation curve of ASIC2a. Competitive GABA A receptor antagonist (IC 50 = 390 nM). Shows nociceptive effects in vivo.

Storage

Store at -20°C

Shipped In

Ice chest + Ice pads

This product requires cold chain shipping. Ground and other economy services are not available.

Action Type

ACTIVATOR

Note

Wherever possible, you should prepare and use solutions on the same day. However, if you need to make up stock solutions in advance, we recommend that you store the solution as aliquots in tightly sealed vials at -20°C. Generally, these will be useable for up to one month. Before use, and prior to opening the vial we recommend that you allow your product to equilibrate to room temperature for at least 1 hour. Need more advice on solubility, usage and handling? Please visit our frequently asked questions (FAQ) page for more details.

Purity

≥98%

Names and Identifiers

• Pubchem Sid: 504767016
• Pubchem Sid Url: https://pubchem.ncbi.nlm.nih.gov/substance/504767016
• Canonical Smiles: CC1=NC(=NC2=CC=CC=C12)N=C(N)N.Cl
• IUPAC Name: 2-(4-methylquinazolin-2-yl)guanidine;hydrochloride
• InChIKey: VNPZWQRWOHFAPD-UHFFFAOYSA-N
• INCHI: 1S/C10H11N5.ClH/c1-6-7-4-2-3-5-8(7)14-10(13-6)15-9(11)12;/h2-5H,1H3,(H4,11,12,13,14,15);1H
• Isomeric SMILES: CC1=NC(=NC2=CC=CC=C12)N=C(N)N.Cl
• WGK Germany: 3
• PubChem CID: 12253739
• Molecular Weight: 237.69

Taxonomic Classification

Taxonomy Tree

• Kingdom Organic compounds
  • Superclass Organoheterocyclic compounds
    • Class Diazanaphthalenes
      • Subclass Benzodiazines
        • Level5 Quinazolines
          • Level6 Quinazolinamines

• Kingdom: Organic compounds
• Superclass: Organoheterocyclic compounds
• Class: Diazanaphthalenes
• Subclass: Benzodiazines
• Intermediate Tree Nodes: Quinazolines
• Direct Parent: Quinazolinamines
• Alternative Parents: Pyrimidines and pyrimidine derivatives Benzenoids Heteroaromatic compounds Guanidines Propargyl-type 1,3-dipolar organic compounds Azacyclic compounds Hydrochlorides Hydrocarbon derivatives
• Molecular Framework: Aromatic heteropolycyclic compounds
• Substituents: Quinazolinamine - Benzenoid - Pyrimidine - Heteroaromatic compound - Guanidine - Azacycle - Organic 1,3-dipolar compound - Propargyl-type 1,3-dipolar organic compound - Organic nitrogen compound - Hydrocarbon derivative - Hydrochloride - Organonitrogen compound - Aromatic heteropolycyclic compound
• Description: This compound belongs to the class of organic compounds known as quinazolinamines. These are heterocyclic aromatic compounds containing a quianazoline moiety substituted by one or more amine groups.
• 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

Chemical and Physical Properties

• Solubility: Soluble in DMSO to 50 mM and in water to 5 mM (with warming)
• Molecular Weight: 237.690 g/mol
• Hydrogen Bond Donor Count: 3
• Hydrogen Bond Acceptor Count: 3
• Rotatable Bond Count: 1
• Exact Mass: 237.078 Da
• Monoisotopic Mass: 237.078 Da
• Topological Polar Surface Area: 90.200 Ų
• Heavy Atom Count: 16
• Formal Charge: 0
• Complexity: 248.000
• 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

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