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A2B receptor antagonist 2 - 99%, high purity , CAS No.784-90-7
Basic Description
Synonyms
2-(4,6,7-trimethylquinazolin-2-yl)guanidine | LS-06684 | AKOS000270442 | SR-01000493214 | MFCD00981386 | A2B receptor antagonist 2 | MLS000688740 | DTXSID30386127 | 2-(4,6,7-Trimethyl-2-quinazolinyl)guanidine | EN300-299452 | EX-A8003D | Z57093758 | N-(4,
Specifications & Purity
≥99%
Biochemical and Physiological Mechanisms
A2B receptor antagonist 2 (compound 18) is an adenosine receptor A 2B antagonist, with K i values of 2.30 μM, 6.8 μM and 3.44 μM for rA 1 , rA 2A and hA 2B , respectively.
Storage Temp
Protected from light,Store at -80°C
Shipped In
Ice chest + Ice pads
This product requires cold chain shipping. Ground and other economy services are not available.
Product Description
A2B receptor antagonist 2 (compound 18) is an adenosine receptor A 2B antagonist, with K i values of 2.30 μM, 6.8 μM and 3.44 μM for rA 1 , rA 2A and hA 2B , respectively.
Form:Solid
Taxonomic Classification
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 Organopnictogen compounds 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 - Organopnictogen compound - Hydrocarbon derivative - 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.
Associated Targets(Human)
Associated Targets(non-human)
Mechanisms of Action
Mechanism of Action
Action Type
target ID
Target Name
Target Type
Target Organism
Binding Site Name
References
Names and Identifiers
IUPAC Name
2-(4,6,7-trimethylquinazolin-2-yl)guanidine
INCHI
InChI=1S/C12H15N5/c1-6-4-9-8(3)15-12(17-11(13)14)16-10(9)5-7(6)2/h4-5H,1-3H3,(H4,13,14,15,16,17)
InChIKey
JFQDHSRWWLJCBV-UHFFFAOYSA-N
Smiles
CC1=CC2=C(N=C(N=C2C=C1C)N=C(N)N)C
Isomeric SMILES
CC1=CC2=C(N=C(N=C2C=C1C)N=C(N)N)C
PubChem CID
2853458
Molecular Weight
229.29
Certificates(CoA,COO,BSE/TSE and Analysis Chart)
Chemical and Physical Properties
Solubility
DMSO : 2 mg/mL (8.72 mM; ultrasonic and warming and heat to 60°C)
Molecular Weight
229.280 g/mol
XLogP3
1.500
Hydrogen Bond Donor Count
2
Hydrogen Bond Acceptor Count
3
Rotatable Bond Count
1
Exact Mass
229.133 Da
Monoisotopic Mass
229.133 Da
Topological Polar Surface Area
90.200 Ų
Heavy Atom Count
17
Formal Charge
0
Complexity
299.000
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
1
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