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Home > Imidazoles > 148533-73-7
148533-73-7 | 1H-Benzimidazole, 6-nitro-2-(4-pyridinyl)-
CAS No: 148533-73-7 Catalog No: AG001KZV MDL No:
Product Description
Catalog Number:
AG001KZV
Chemical Name:
1H-Benzimidazole, 6-nitro-2-(4-pyridinyl)-
CAS Number:
148533-73-7
Molecular Formula:
C12H8N4O2
Molecular Weight:
240.2175
IUPAC Name:
6-nitro-2-pyridin-4-yl-1H-benzimidazole
InChI:
InChI=1S/C12H8N4O2/c17-16(18)9-1-2-10-11(7-9)15-12(14-10)8-3-5-13-6-4-8/h1-7H,(H,14,15)
InChI Key:
MPOIUZUPKNLRIJ-UHFFFAOYSA-N
SMILES:
[O-][N+](=O)c1ccc2c(c1)[nH]c(n2)c1ccncc1
Properties
Complexity:
314
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
240.065g/mol
Formal Charge:
0
Heavy Atom Count:
18
Hydrogen Bond Acceptor Count:
4
Hydrogen Bond Donor Count:
1
Isotope Atom Count:
0
Molecular Weight:
240.222g/mol
Monoisotopic Mass:
240.065g/mol
Rotatable Bond Count:
1
Topological Polar Surface Area:
87.4A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
2.4
Literature
| Title | Journal |
|---|---|
| 6-Nitrobenzimidazole derivatives: potential phosphodiesterase inhibitors: synthesis and structure-activity relationship. | Bioorganic & medicinal chemistry 20120215 |
| 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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