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95523-13-0

95523-13-0 Structure

95523-13-0 Structure
IdentificationBack Directory
[Name]

N6-(P-AMINOBENZYL)ADENOSINE
[CAS]

95523-13-0
[Synonyms]

N6-(P-AMINOBENZYL)ADENOSINE
N(sup 6)(p-aminobenzyl)adenosine
N-[(4-Aminophenyl)methyl]adenosine
[125I]-N6-(4-Aminobenzyl)adenosine
Adenosine, N-[(4-aminophenyl)methyl]-
N [(4 Aminophenyl)methyl]adenosine,N[(4Aminophenyl)methyl]adenosine
[Molecular Formula]

C17H20N6O4
[MDL Number]

MFCD00083216
[MOL File]

95523-13-0.mol
[Molecular Weight]

372.38
Chemical PropertiesBack Directory
[Boiling point ]

749.0±70.0 °C(Predicted)
[density ]

1.71±0.1 g/cm3(Predicted)
[storage temp. ]

2-8°C
[solubility ]

Soluble in DMSO
[form ]

Solid
[pka]

13.12±0.70(Predicted)
[color ]

Off-white to light yellow
Hazard InformationBack Directory
[Uses]

N-[(4-Aminophenyl)methyl]adenosine is a adenosine receptor inhibitor, with Ki of 29 nM for Rat ecto-5′-Nucleotidase. IC50 value: 29.0 ± 1.7 nM (Ki) Target: Adenosine Receptor
[References]

[1] Bhattarai S, et al. α,β-Methylene-ADP (AOPCP) Derivatives and Analogues: Development of Potent and Selective ecto-5'-Nucleotidase (CD73) Inhibitors. J Med Chem. 2015 Aug 13;58(15):6248-63. DOI:10.1021/acs.jmedchem.5b00802
[2] Chen JB, et al. Design and synthesis of novel dual-action compounds targeting the adenosine A(2A) receptor and adenosine transporter for neuroprotection. ChemMedChem. 2011 Aug 1;6(8):1390-400. DOI:10.1002/cmdc.201100126
[3] Zhu Z, et al. Constrained NBMPR analogue synthesis, pharmacophore mapping and 3D-QSAR modeling of equilibrative nucleoside transporter 1 (ENT1) inhibitory activity. Bioorg Med Chem. 2008 Apr 1;16(7):3848-65. DOI:10.1016/j.bmc.2008.01.044
Spectrum DetailBack Directory
[Spectrum Detail]

N6-(P-AMINOBENZYL)ADENOSINE(95523-13-0)1HNMR
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