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824394-77-6 | 1H-Benzimidazole, 2-[2-(4-phenyl-1H-imidazol-2-yl)phenyl]-
CAS No: 824394-77-6 Catalog No: AG005B4T MDL No:
Product Description
Catalog Number:
AG005B4T
Chemical Name:
1H-Benzimidazole, 2-[2-(4-phenyl-1H-imidazol-2-yl)phenyl]-
CAS Number:
824394-77-6
Molecular Formula:
C22H16N4
Molecular Weight:
336.3892
IUPAC Name:
2-[2-(5-phenyl-1H-imidazol-2-yl)phenyl]-1H-benzimidazole
InChI:
InChI=1S/C22H16N4/c1-2-8-15(9-3-1)20-14-23-21(26-20)16-10-4-5-11-17(16)22-24-18-12-6-7-13-19(18)25-22/h1-14H,(H,23,26)(H,24,25)
InChI Key:
OILOWXQJRMEUMY-UHFFFAOYSA-N
SMILES:
c1ccc(cc1)c1c[nH]c(n1)c1ccccc1c1nc2c([nH]1)cccc2
Properties
Complexity:
463
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
336.137g/mol
Formal Charge:
0
Heavy Atom Count:
26
Hydrogen Bond Acceptor Count:
2
Hydrogen Bond Donor Count:
2
Isotope Atom Count:
0
Molecular Weight:
336.398g/mol
Monoisotopic Mass:
336.137g/mol
Rotatable Bond Count:
3
Topological Polar Surface Area:
57.4A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
4.7
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