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136629-58-8

136629-58-8 | 1H-Benzimidazole, 5,5'-methylenebis[1-methyl-2-(6-methyl-2-pyridinyl)-

CAS No: 136629-58-8 Catalog No: AG00800N MDL No:

Product Description

Catalog Number:
AG00800N
Chemical Name:
1H-Benzimidazole, 5,5'-methylenebis[1-methyl-2-(6-methyl-2-pyridinyl)-
CAS Number:
136629-58-8
Molecular Formula:
C29H26N6
Molecular Weight:
458.5569
IUPAC Name:
1-methyl-5-[[1-methyl-2-(6-methylpyridin-2-yl)benzimidazol-5-yl]methyl]-2-(6-methylpyridin-2-yl)benzimidazole
InChI:
InChI=1S/C29H26N6/c1-18-7-5-9-22(30-18)28-32-24-16-20(11-13-26(24)34(28)3)15-21-12-14-27-25(17-21)33-29(35(27)4)23-10-6-8-19(2)31-23/h5-14,16-17H,15H2,1-4H3
InChI Key:
CAOGYUMIWBCWBN-UHFFFAOYSA-N
SMILES:
Cc1cccc(n1)c1nc2c(n1C)ccc(c2)Cc1ccc2c(c1)nc(n2C)c1cccc(n1)C

Properties

Complexity:
659  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
458.222g/mol
Formal Charge:
0
Heavy Atom Count:
35  
Hydrogen Bond Acceptor Count:
4  
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
458.569g/mol
Monoisotopic Mass:
458.222g/mol
Rotatable Bond Count:
4  
Topological Polar Surface Area:
61.4A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
4.9  

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