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88406-57-9

88406-57-9 | 1H-Imidazo[4,5-b]pyridine, 5-methyl-2-phenyl-

CAS No: 88406-57-9 Catalog No: AG004F3I MDL No:

Product Description

Catalog Number:
AG004F3I
Chemical Name:
1H-Imidazo[4,5-b]pyridine, 5-methyl-2-phenyl-
CAS Number:
88406-57-9
Molecular Formula:
C13H11N3
Molecular Weight:
209.2465
IUPAC Name:
5-methyl-2-phenyl-1H-imidazo[4,5-b]pyridine
InChI:
InChI=1S/C13H11N3/c1-9-7-8-11-13(14-9)16-12(15-11)10-5-3-2-4-6-10/h2-8H,1H3,(H,14,15,16)
InChI Key:
OZGGWNLOCZYTMP-UHFFFAOYSA-N
SMILES:
Cc1ccc2c(n1)nc([nH]2)c1ccccc1

Properties

Complexity:
237  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
209.095g/mol
Formal Charge:
0
Heavy Atom Count:
16  
Hydrogen Bond Acceptor Count:
2  
Hydrogen Bond Donor Count:
1  
Isotope Atom Count:
0
Molecular Weight:
209.252g/mol
Monoisotopic Mass:
209.095g/mol
Rotatable Bond Count:
1  
Topological Polar Surface Area:
41.6A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
2.8  

Literature

Title Journal
Discovery of heterobicyclic templates for novel metabotropic glutamate receptor subtype 5 antagonists. Bioorganic & medicinal chemistry letters 20070601

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