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Home > Imidazoles > 91452-87-8
91452-87-8 | 1H-Benzimidazole, 2,2'-(2,6-naphthalenediyl)bis[5-methyl-
CAS No: 91452-87-8 Catalog No: AG006AOC MDL No:
Product Description
Catalog Number:
AG006AOC
Chemical Name:
1H-Benzimidazole, 2,2'-(2,6-naphthalenediyl)bis[5-methyl-
CAS Number:
91452-87-8
Molecular Formula:
C26H20N4
Molecular Weight:
388.4638
IUPAC Name:
6-methyl-2-[6-(6-methyl-1H-benzimidazol-2-yl)naphthalen-2-yl]-1H-benzimidazole
InChI:
InChI=1S/C26H20N4/c1-15-3-9-21-23(11-15)29-25(27-21)19-7-5-18-14-20(8-6-17(18)13-19)26-28-22-10-4-16(2)12-24(22)30-26/h3-14H,1-2H3,(H,27,29)(H,28,30)
InChI Key:
WDQHPVTYIONEAC-UHFFFAOYSA-N
SMILES:
Cc1ccc2c(c1)nc([nH]2)c1ccc2c(c1)ccc(c2)c1nc2c([nH]1)ccc(c2)C
Properties
Complexity:
558
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
388.169g/mol
Formal Charge:
0
Heavy Atom Count:
30
Hydrogen Bond Acceptor Count:
2
Hydrogen Bond Donor Count:
2
Isotope Atom Count:
0
Molecular Weight:
388.474g/mol
Monoisotopic Mass:
388.169g/mol
Rotatable Bond Count:
2
Topological Polar Surface Area:
57.4A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
6.4
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