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MRS 1706

CAS No.:
264622-53-9
Catalog Number:
AG00C4HV
Molecular Formula:
C27H29N5O5
Molecular Weight:
503.5497
Pack Size
Purity
Availability
Location
Price(USD)
Quantity
  
1mg
≥95%
1 week
United States
$91
- +
5mg
≥95%
1 week
United States
$179
- +
10mg
98%
1 week
United States
$265
- +
50mg
98%
1 week
United States
$890
- +
100mg
98%
1 week
United States
$1585
- +
Product Description
Catalog Number:
AG00C4HV
Chemical Name:
MRS 1706
CAS Number:
264622-53-9
Molecular Formula:
C27H29N5O5
Molecular Weight:
503.5497
MDL Number:
MFCD28160689
IUPAC Name:
N-(4-acetylphenyl)-2-[4-(2,6-dioxo-1,3-dipropyl-7H-purin-8-yl)phenoxy]acetamide
InChI:
InChI=1S/C27H29N5O5/c1-4-14-31-25-23(26(35)32(15-5-2)27(31)36)29-24(30-25)19-8-12-21(13-9-19)37-16-22(34)28-20-10-6-18(7-11-20)17(3)33/h6-13H,4-5,14-16H2,1-3H3,(H,28,34)(H,29,30)
InChI Key:
ZKUCFFYOQOJLGT-UHFFFAOYSA-N
SMILES:
CCCn1c2nc([nH]c2c(=O)n(c1=O)CCC)c1ccc(cc1)OCC(=O)Nc1ccc(cc1)C(=O)C
Properties
Complexity:
837  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
503.217g/mol
Formal Charge:
0
Heavy Atom Count:
37  
Hydrogen Bond Acceptor Count:
6  
Hydrogen Bond Donor Count:
2  
Isotope Atom Count:
0
Molecular Weight:
503.559g/mol
Monoisotopic Mass:
503.217g/mol
Rotatable Bond Count:
10  
Topological Polar Surface Area:
125A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
4.9  
Literature
Title Journal
Adenosine A2A and A2B Receptor Substantially Attenuate Ischemia/Reperfusion Injury in Septic rat Hearts. Cardiovascular drugs and therapy 20160101
Insights into binding modes of adenosine A(2B) antagonists with ligand-based and receptor-based methods. European journal of medicinal chemistry 20100801
Angiotensin II enhances the afferent arteriolar response to adenosine through increases in cytosolic calcium. Acta physiologica (Oxford, England) 20090801
Adenosine receptor subtypes in the airways responses to 5'-adenosine monophosphate inhalation of sensitized guinea-pigs. Clinical and experimental allergy : journal of the British Society for Allergy and Clinical Immunology 20080901
Effect of A2B adenosine receptor gene ablation on proinflammatory adenosine signaling in mast cells. Journal of immunology (Baltimore, Md. : 1950) 20080601
Local stimulation of the adenosine A2B receptors induces an increased release of IL-6 in mouse striatum: an in vivo microdialysis study. Journal of neurochemistry 20080501
In vivo adenosine A(2B) receptor desensitization in guinea-pig airway smooth muscle: implications for asthma. European journal of pharmacology 20071201
A(2b) receptor mediates adenosine inhibition of taurine efflux from pituicytes. Biology of the cell 20070801
Determination of adenosine effects and adenosine receptors in murine corpus cavernosum. The Journal of pharmacology and experimental therapeutics 20070801
ZM241385, DPCPX, MRS1706 are inverse agonists with different relative intrinsic efficacies on constitutively active mutants of the human adenosine A2B receptor. The Journal of pharmacology and experimental therapeutics 20070201
Contribution of adenosine receptors in the control of arteriolar tone and adenosine-angiotensin II interaction. Kidney international 20060801
Characterization of adenosine receptors in the human bladder carcinoma T24 cell line. European journal of pharmacology 20060424
Adenosine A2A receptor stimulation increases angiogenesis by down-regulating production of the antiangiogenic matrix protein thrombospondin 1. Molecular pharmacology 20050501
Regulation of A2B adenosine receptor functioning by tumour necrosis factor a in human astroglial cells. Journal of neurochemistry 20041201
Adenosine receptors involved in modulation of noradrenaline release in isolated rat tail artery. European journal of pharmacology 20041103
Anilide derivatives of an 8-phenylxanthine carboxylic congener are highly potent and selective antagonists at human A(2B) adenosine receptors. Journal of medicinal chemistry 20000323
Properties