Home Carboxys 5-methyl-2-(3-methylphenyl)-1H-imidazole-4-carboxylic acid

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

CAS No.:
1225511-16-9
Catalog Number:
AG01E8DO
Molecular Formula:
Molecular Weight:
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Product Description
Catalog Number:
AG01E8DO
Chemical Name:
5-methyl-2-(3-methylphenyl)-1H-imidazole-4-carboxylic acid
CAS Number:
1225511-16-9
MDL Number:
MFCD16153809
IUPAC Name:
5-methyl-2-(3-methylphenyl)-1H-imidazole-4-carboxylic acid
InChI:
InChI=1S/C12H12N2O2/c1-7-4-3-5-9(6-7)11-13-8(2)10(14-11)12(15)16/h3-6H,1-2H3,(H,13,14)(H,15,16)
InChI Key:
QKGAYNNYZHJULN-UHFFFAOYSA-N
Properties
Complexity:
270  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
216.09g/mol
Formal Charge:
0
Heavy Atom Count:
16  
Hydrogen Bond Acceptor Count:
3  
Hydrogen Bond Donor Count:
2  
Isotope Atom Count:
0
Molecular Weight:
216.24g/mol
Monoisotopic Mass:
216.09g/mol
Rotatable Bond Count:
2  
Topological Polar Surface Area:
66A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
2.3  
Literature
Title Journal
Discovery of cell-active phenyl-imidazole Pin1 inhibitors by structure-guided fragment evolution. Bioorganic & medicinal chemistry letters 20101115
Properties