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Home > Bromides > 1137475-57-0
1137475-57-0 | Pyridine, 2-bromo-4-chloro-5-nitro-
CAS No: 1137475-57-0 Catalog No: AG0009JV MDL No:MFCD17014975
Product Description
Catalog Number:
AG0009JV
Chemical Name:
Pyridine, 2-bromo-4-chloro-5-nitro-
CAS Number:
1137475-57-0
Molecular Formula:
C5H2BrClN2O2
Molecular Weight:
237.4386
MDL Number:
MFCD17014975
IUPAC Name:
2-bromo-4-chloro-5-nitropyridine
InChI:
InChI=1S/C5H2BrClN2O2/c6-5-1-3(7)4(2-8-5)9(10)11/h1-2H
InChI Key:
HJWNYVVSEUNNMO-UHFFFAOYSA-N
SMILES:
[O-][N+](=O)c1cnc(cc1Cl)Br
Properties
Complexity:
163
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
235.899g/mol
Formal Charge:
0
Heavy Atom Count:
11
Hydrogen Bond Acceptor Count:
3
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
237.437g/mol
Monoisotopic Mass:
235.899g/mol
Rotatable Bond Count:
0
Topological Polar Surface Area:
58.7A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
2.3
Literature
| Title | Journal |
|---|---|
| Structure-guided evolution of potent and selective CHK1 inhibitors through scaffold morphing. | Journal of medicinal chemistry 20111222 |
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