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2208-59-5 | 2-(Pyridin-4-yl)-1H-benzo[d]imidazole
CAS No: 2208-59-5 Catalog No: AG003EXK MDL No:MFCD00453948
Product Description
Catalog Number:
AG003EXK
Chemical Name:
2-(Pyridin-4-yl)-1H-benzo[d]imidazole
CAS Number:
2208-59-5
Molecular Formula:
C12H9N3
Molecular Weight:
195.2200
MDL Number:
MFCD00453948
IUPAC Name:
2-pyridin-4-yl-1H-benzimidazole
InChI:
InChI=1S/C12H9N3/c1-2-4-11-10(3-1)14-12(15-11)9-5-7-13-8-6-9/h1-8H,(H,14,15)
InChI Key:
UYWWLYCGNNCLKE-UHFFFAOYSA-N
SMILES:
n1ccc(cc1)c1nc2c([nH]1)cccc2
NSC Number:
62609
Properties
Complexity:
213
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
195.08g/mol
Formal Charge:
0
Heavy Atom Count:
15
Hydrogen Bond Acceptor Count:
2
Hydrogen Bond Donor Count:
1
Isotope Atom Count:
0
Molecular Weight:
195.225g/mol
Monoisotopic Mass:
195.08g/mol
Rotatable Bond Count:
1
Topological Polar Surface Area:
41.6A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
2.2
Literature
| Title | Journal |
|---|---|
| Synthesis, in vitro and in silico NS5B polymerase inhibitory activity of benzimidazole derivatives. | Medicinal chemistry (Shariqah (United Arab Emirates)) 20120701 |
| 2-(4-Pyridinio)benzimidazolium tetra-chloridopalladium(II). | Acta crystallographica. Section E, Structure reports online 20090201 |
| Design, microwave-assisted synthesis, and spasmolytic activity of 2-(alkyloxyaryl)-1H-benzimidazole derivatives as constrained stilbene bioisosteres. | Bioorganic & medicinal chemistry letters 20060815 |
| Microsphere-based protease assays and screening application for lethal factor and factor Xa. | Cytometry. Part A : the journal of the International Society for Analytical Cytology 20060501 |
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