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Home Halogens 2-(3-chlorophenyl)-5-methyl-1H-imidazole-4-carboxylic acid

2-(3-chlorophenyl)-5-methyl-1H-imidazole-4-carboxylic acid

CAS No.:
1226001-92-8
Catalog Number:
AG01E8D6
Molecular Formula:
Molecular Weight:
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Product Description
Catalog Number:
AG01E8D6
Chemical Name:
2-(3-chlorophenyl)-5-methyl-1H-imidazole-4-carboxylic acid
CAS Number:
1226001-92-8
MDL Number:
MFCD16319503
IUPAC Name:
2-(3-chlorophenyl)-5-methyl-1H-imidazole-4-carboxylic acid
InChI:
InChI=1S/C11H9ClN2O2/c1-6-9(11(15)16)14-10(13-6)7-3-2-4-8(12)5-7/h2-5H,1H3,(H,13,14)(H,15,16)
InChI Key:
AZJGRTCDZBQXFC-UHFFFAOYSA-N
Properties
Complexity:
275  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
236.035g/mol
Formal Charge:
0
Heavy Atom Count:
16  
Hydrogen Bond Acceptor Count:
3  
Hydrogen Bond Donor Count:
2  
Isotope Atom Count:
0
Molecular Weight:
236.655g/mol
Monoisotopic Mass:
236.035g/mol
Rotatable Bond Count:
2  
Topological Polar Surface Area:
66A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
2.6  
Literature
Title Journal
Discovery of cell-active phenyl-imidazole Pin1 inhibitors by structure-guided fragment evolution. Bioorganic & medicinal chemistry letters 20101115
Properties