Home Other Building Blocks 1H-Pyrazolo[3,4-d]pyrimidin-4-amine

1H-Pyrazolo[3,4-d]pyrimidin-4-amine

CAS No.:
2380-63-4
Catalog Number:
AG0033WT
Molecular Formula:
C5H5N5
Molecular Weight:
135.1267
Pack Size
Purity
Availability
Location
Price(USD)
Quantity
  
1g
95%
In Stock USA
United States
$33
- +
5g
95%
In Stock USA
United States
$40
- +
25g
95%
In Stock USA
United States
$82
- +
100g
95%
In Stock USA
United States
$172
- +
500g
95%
In Stock USA
United States
$478
- +
Product Description
Catalog Number:
AG0033WT
Chemical Name:
1H-Pyrazolo[3,4-d]pyrimidin-4-amine
CAS Number:
2380-63-4
Molecular Formula:
C5H5N5
Molecular Weight:
135.1267
MDL Number:
MFCD00005688
IUPAC Name:
1H-pyrazolo[3,4-d]pyrimidin-4-amine
InChI:
InChI=1S/C5H5N5/c6-4-3-1-9-10-5(3)8-2-7-4/h1-2H,(H3,6,7,8,9,10)
InChI Key:
LHCPRYRLDOSKHK-UHFFFAOYSA-N
SMILES:
Nc1ncnc2c1cn[nH]2
UNII:
0356MAT9LX
NSC Number:
1393
Properties
Complexity:
127  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
135.054g/mol
Formal Charge:
0
Heavy Atom Count:
10  
Hydrogen Bond Acceptor Count:
4  
Hydrogen Bond Donor Count:
2  
Isotope Atom Count:
0
Molecular Weight:
135.13g/mol
Monoisotopic Mass:
135.054g/mol
Rotatable Bond Count:
0
Topological Polar Surface Area:
80.5A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
-0.2  
Literature
Title Journal
Spectroscopic, electronic structure and natural bond analysis of 2-aminopyrimidine and 4-aminopyrazolo[3,4-d]pyrimidine: a comparative study. Spectrochimica acta. Part A, Molecular and biomolecular spectroscopy 20121001
Vibrational analysis of 4-amino pyrazolo (3,4-d) pyrimidine A joint FTIR, Laser Raman and scaled quantum mechanical studies. Spectrochimica acta. Part A, Molecular and biomolecular spectroscopy 20111101
Synthesis and characterization of two novel organic-inorganic compounds based on tetrahexyl and tetraheptyl ammonium ions and the Preyssler anion and their catalytic activities in the synthesis of 4-aminopyrazolo[3,4-d]- pyrimidines. Molecules (Basel, Switzerland) 20100408
Clinical grade production and characterization of a fusion protein comprised of the chemokine CCL2-ligand genetically fused to a mutated and truncated form of the Shiga A1 subunit. Protein expression and purification 20090801
The screening and characterization of 6-aminopurine-based xanthine oxidase inhibitors. Bioorganic & medicinal chemistry 20070515
Novel, highly potent adenosine deaminase inhibitors containing the pyrazolo[3,4-d]pyrimidine ring system. Synthesis, structure-activity relationships, and molecular modeling studies. Journal of medicinal chemistry 20050811
Prediction of genotoxicity of chemical compounds by statistical learning methods. Chemical research in toxicology 20050601
Synthesis and biological activity of 2'-deoxy-4'-thio-pyrazolo[3,4-d]pyrimidine nucleosides. Nucleosides, nucleotides & nucleic acids 20050101
[Riboflavin overproduction in 4-aminopyrazole[3,4-d]pyrimidine-treated yeast Pichia guilliermondii]. Prikladnaia biokhimiia i mikrobiologiia 20020101
Structure-activity relationships for the binding of ligands to xanthine or guanine phosphoribosyl-transferase from Toxoplasma gondii. Biochemical pharmacology 19951109
Properties