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78473-10-6 | 2-Aminopyridine-3,5-dicarbonitrile
CAS No: 78473-10-6 Catalog No: AG00539J MDL No:MFCD00462247
Product Description
Catalog Number:
AG00539J
Chemical Name:
2-Aminopyridine-3,5-dicarbonitrile
CAS Number:
78473-10-6
Molecular Formula:
C7H4N4
Molecular Weight:
144.1335
MDL Number:
MFCD00462247
IUPAC Name:
2-aminopyridine-3,5-dicarbonitrile
InChI:
InChI=1S/C7H4N4/c8-2-5-1-6(3-9)7(10)11-4-5/h1,4H,(H2,10,11)
InChI Key:
YLZXGBMEWRIPQX-UHFFFAOYSA-N
SMILES:
N#Cc1cnc(c(c1)C#N)N
NSC Number:
165541
Properties
Complexity:
229
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:
4
Hydrogen Bond Donor Count:
1
Isotope Atom Count:
0
Molecular Weight:
144.137g/mol
Monoisotopic Mass:
144.044g/mol
Rotatable Bond Count:
0
Topological Polar Surface Area:
86.5A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
0.5
Literature
| Title | Journal |
|---|---|
| Structure-activity relationship study of prion inhibition by 2-aminopyridine-3,5-dicarbonitrile-based compounds: parallel synthesis, bioactivity, and in vitro pharmacokinetics. | Journal of medicinal chemistry 20070111 |
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