Home Halogens 5-chloro-2-(2,5-dimethyl-1H-pyrrol-1-yl)benzoic acid

5-chloro-2-(2,5-dimethyl-1H-pyrrol-1-yl)benzoic acid

CAS No.:
292058-57-2
Catalog Number:
AG01C5PU
Molecular Formula:
Molecular Weight:
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Product Description
Catalog Number:
AG01C5PU
Chemical Name:
5-chloro-2-(2,5-dimethyl-1H-pyrrol-1-yl)benzoic acid
CAS Number:
292058-57-2
MDL Number:
MFCD02108882
IUPAC Name:
5-chloro-2-(2,5-dimethylpyrrol-1-yl)benzoic acid
InChI:
InChI=1S/C13H12ClNO2/c1-8-3-4-9(2)15(8)12-6-5-10(14)7-11(12)13(16)17/h3-7H,1-2H3,(H,16,17)
InChI Key:
ZUNYXBKRXNVRLI-UHFFFAOYSA-N
Properties
Complexity:
287  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
249.056g/mol
Formal Charge:
0
Heavy Atom Count:
17  
Hydrogen Bond Acceptor Count:
2  
Hydrogen Bond Donor Count:
1  
Isotope Atom Count:
0
Molecular Weight:
249.694g/mol
Monoisotopic Mass:
249.056g/mol
Rotatable Bond Count:
2  
Topological Polar Surface Area:
42.2A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
3.3  
Literature
Title Journal
Identification and characterization of inhibitors of the aminoglycoside resistance acetyltransferase Eis from Mycobacterium tuberculosis. ChemMedChem 20120102
Design, synthesis, and biological evaluation of N-carboxyphenylpyrrole derivatives as potent HIV fusion inhibitors targeting gp41. Journal of medicinal chemistry 20081225
Properties