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Home > Imidazoles > 14624-88-5
14624-88-5 | 1-BENZYL-2-METHYL-5-NITRO-1H-1,3-BENZIMIDAZOLE
CAS No: 14624-88-5 Catalog No: AG007YH3 MDL No:MFCD08688839
Product Description
Catalog Number:
AG007YH3
Chemical Name:
1-BENZYL-2-METHYL-5-NITRO-1H-1,3-BENZIMIDAZOLE
CAS Number:
14624-88-5
Molecular Formula:
C15H13N3O2
Molecular Weight:
267.2826
MDL Number:
MFCD08688839
IUPAC Name:
1-benzyl-2-methyl-5-nitrobenzimidazole
InChI:
InChI=1S/C15H13N3O2/c1-11-16-14-9-13(18(19)20)7-8-15(14)17(11)10-12-5-3-2-4-6-12/h2-9H,10H2,1H3
InChI Key:
DKGAUUAVZGGUIJ-UHFFFAOYSA-N
SMILES:
[O-][N+](=O)c1ccc2c(c1)nc(n2Cc1ccccc1)C
Properties
Complexity:
352
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
267.101g/mol
Formal Charge:
0
Heavy Atom Count:
20
Hydrogen Bond Acceptor Count:
3
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
267.288g/mol
Monoisotopic Mass:
267.101g/mol
Rotatable Bond Count:
2
Topological Polar Surface Area:
63.6A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
3.3
Literature
| Title | Journal |
|---|---|
| Synthesis and inhibitory activity of new benzimidazole derivatives against Burkitt's lymphoma promotion. | Bioorganic & medicinal chemistry 20071001 |
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