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Home Halogens 2-Amino-6-chloropyrazine

2-Amino-6-chloropyrazine

CAS No.:
33332-28-4
Catalog Number:
AG00338O
Molecular Formula:
C4H4ClN3
Molecular Weight:
129.5477
Pack Size
Purity
Availability
Location
Price(USD)
Quantity
  
5g
95%
In Stock USA
United States
$13
- +
25g
95%
In Stock USA
United States
$34
- +
100g
98%
In Stock USA
United States
$125
- +
500g
98%
In Stock USA
United States
$494
- +
Product Description
Catalog Number:
AG00338O
Chemical Name:
2-Amino-6-chloropyrazine
CAS Number:
33332-28-4
Molecular Formula:
C4H4ClN3
Molecular Weight:
129.5477
MDL Number:
MFCD00055024
IUPAC Name:
6-chloropyrazin-2-amine
InChI:
InChI=1S/C4H4ClN3/c5-3-1-7-2-4(6)8-3/h1-2H,(H2,6,8)
InChI Key:
JTPXVCKCLBROOJ-UHFFFAOYSA-N
SMILES:
Nc1cncc(n1)Cl
Properties
Complexity:
77.7  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
129.009g/mol
Formal Charge:
0
Heavy Atom Count:
8  
Hydrogen Bond Acceptor Count:
3  
Hydrogen Bond Donor Count:
1  
Isotope Atom Count:
0
Molecular Weight:
129.547g/mol
Monoisotopic Mass:
129.009g/mol
Rotatable Bond Count:
0
Topological Polar Surface Area:
51.8A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
0.9  
Literature
Title Journal
Structure-guided evolution of potent and selective CHK1 inhibitors through scaffold morphing. Journal of medicinal chemistry 20111222
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
Fragment-based lead discovery using X-ray crystallography. Journal of medicinal chemistry 20050127
Properties