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Home Other Building Blocks 2,5'-Bi-1H-benzimidazole, 2'-(3,4-dimethoxyphenyl)-5-(4-methyl-1-piperazinyl)-

2,5'-Bi-1H-benzimidazole, 2'-(3,4-dimethoxyphenyl)-5-(4-methyl-1-piperazinyl)-

CAS No.:
188860-26-6
Catalog Number:
AG002HFL
Molecular Formula:
C27H28N6O2
Molecular Weight:
468.5502
Pack Size
Purity
Availability
Location
Price(USD)
Quantity
  
5mg
99%
1 week
United States
$157
- +
10mg
99%
1 week
United States
$207
- +
50mg
99%
1 week
United States
$657
- +
100mg
99%
1 week
United States
$1157
- +
Product Description
Catalog Number:
AG002HFL
Chemical Name:
2,5'-Bi-1H-benzimidazole, 2'-(3,4-dimethoxyphenyl)-5-(4-methyl-1-piperazinyl)-
CAS Number:
188860-26-6
Molecular Formula:
C27H28N6O2
Molecular Weight:
468.5502
IUPAC Name:
2-(3,4-dimethoxyphenyl)-6-[6-(4-methylpiperazin-1-yl)-1H-benzimidazol-2-yl]-1H-benzimidazole
InChI:
InChI=1S/C27H28N6O2/c1-32-10-12-33(13-11-32)19-6-8-21-23(16-19)31-26(29-21)17-4-7-20-22(14-17)30-27(28-20)18-5-9-24(34-2)25(15-18)35-3/h4-9,14-16H,10-13H2,1-3H3,(H,28,30)(H,29,31)
InChI Key:
BMRRDFCQNOZNNR-UHFFFAOYSA-N
SMILES:
COc1cc(ccc1OC)c1[nH]c2c(n1)cc(cc2)c1nc2c([nH]1)ccc(c2)N1CCN(CC1)C
Properties
Complexity:
705  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
468.227g/mol
Formal Charge:
0
Heavy Atom Count:
35  
Hydrogen Bond Acceptor Count:
6  
Hydrogen Bond Donor Count:
2  
Isotope Atom Count:
0
Molecular Weight:
468.561g/mol
Monoisotopic Mass:
468.227g/mol
Rotatable Bond Count:
5  
Topological Polar Surface Area:
82.3A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
4.3  
Literature
Title Journal
Synthesis and biological activity of novel inhibitors of topoisomerase I: 2-aryl-substituted 2-bis-1H-benzimidazoles. European journal of medicinal chemistry 20110201
Old class but new dimethoxy analogue of benzimidazole: a bacterial topoisomerase I inhibitor. International journal of antimicrobial agents 20100201
Minor groove binding DNA ligands with expanded A/T sequence length recognition, selective binding to bent DNA regions and enhanced fluorescent properties. Biochemistry 20031118
Influence of phenyl ring disubstitution on bisbenzimidazole and terbenzimidazole cytotoxicity: synthesis and biological evaluation as radioprotectors. Journal of medicinal chemistry 20030828
Properties