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Home Nitriles 7-Aminopyrazolo[1,5-a]pyrimidine-6-carbonitrile

7-Aminopyrazolo[1,5-a]pyrimidine-6-carbonitrile

CAS No.:
89975-57-5
Catalog Number:
AG003ND0
Molecular Formula:
C7H5N5
Molecular Weight:
159.1481
Pack Size
Purity
Availability
Location
Price(USD)
Quantity
  
1g
>97%
In Stock USA
United States
$121
- +
5g
>97%
In Stock USA
United States
$290
- +
Product Description
Catalog Number:
AG003ND0
Chemical Name:
7-Aminopyrazolo[1,5-a]pyrimidine-6-carbonitrile
CAS Number:
89975-57-5
Molecular Formula:
C7H5N5
Molecular Weight:
159.1481
MDL Number:
MFCD00104599
IUPAC Name:
7-aminopyrazolo[1,5-a]pyrimidine-6-carbonitrile
InChI:
InChI=1S/C7H5N5/c8-3-5-4-10-6-1-2-11-12(6)7(5)9/h1-2,4H,9H2
InChI Key:
XBKLUCYMMSKAEI-UHFFFAOYSA-N
SMILES:
N#Cc1cnc2n(c1N)ncc2
Properties
Complexity:
219  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
159.054g/mol
Formal Charge:
0
Heavy Atom Count:
12  
Hydrogen Bond Acceptor Count:
4  
Hydrogen Bond Donor Count:
1  
Isotope Atom Count:
0
Molecular Weight:
159.152g/mol
Monoisotopic Mass:
159.054g/mol
Rotatable Bond Count:
0
Topological Polar Surface Area:
80A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
0.2  
Literature
Title Journal
Synthesis and SAR studies of 1,4-benzoxazine MenB inhibitors: novel antibacterial agents against Mycobacterium tuberculosis. Bioorganic & medicinal chemistry letters 20101101
Properties