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Home Nitriles Pyrazolo[1,5-a]pyrimidine-3-carbonitrile

Pyrazolo[1,5-a]pyrimidine-3-carbonitrile

CAS No.:
25939-87-1
Catalog Number:
AG002R49
Molecular Formula:
C7H4N4
Molecular Weight:
144.1335
Pack Size
Purity
Availability
Location
Price(USD)
Quantity
  
1g
97%
1 week
United States
$145
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Product Description
Catalog Number:
AG002R49
Chemical Name:
Pyrazolo[1,5-a]pyrimidine-3-carbonitrile
CAS Number:
25939-87-1
Molecular Formula:
C7H4N4
Molecular Weight:
144.1335
MDL Number:
MFCD01927799
IUPAC Name:
pyrazolo[1,5-a]pyrimidine-3-carbonitrile
InChI:
InChI=1S/C7H4N4/c8-4-6-5-10-11-3-1-2-9-7(6)11/h1-3,5H
InChI Key:
RRHORVAOECWFPT-UHFFFAOYSA-N
SMILES:
N#Cc1cnn2c1nccc2
Properties
Complexity:
194  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
144.044g/mol
Formal Charge:
0
Heavy Atom Count:
11  
Hydrogen Bond Acceptor Count:
3  
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
144.137g/mol
Monoisotopic Mass:
144.044g/mol
Rotatable Bond Count:
0
Topological Polar Surface Area:
54A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
0
Literature
Title Journal
Identification of N-(4-piperidinyl)-4-(2,6-dichlorobenzoylamino)-1H-pyrazole-3-carboxamide (AT7519), a novel cyclin dependent kinase inhibitor using fragment-based X-ray crystallography and structure based drug design. Journal of medicinal chemistry 20080828
Properties