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824394-91-4 | 1H-Benzimidazole, 2-[2-(1H-imidazol-2-yl)phenyl]-1-methyl-
CAS No: 824394-91-4 Catalog No: AG008JVL MDL No:
Product Description
Catalog Number:
AG008JVL
Chemical Name:
1H-Benzimidazole, 2-[2-(1H-imidazol-2-yl)phenyl]-1-methyl-
CAS Number:
824394-91-4
Molecular Formula:
C17H14N4
Molecular Weight:
274.3199
IUPAC Name:
2-[2-(1H-imidazol-2-yl)phenyl]-1-methylbenzimidazole
InChI:
InChI=1S/C17H14N4/c1-21-15-9-5-4-8-14(15)20-17(21)13-7-3-2-6-12(13)16-18-10-11-19-16/h2-11H,1H3,(H,18,19)
InChI Key:
OGDISRQEVSJCCY-UHFFFAOYSA-N
SMILES:
Cn1c(nc2c1cccc2)c1ccccc1c1ncc[nH]1
Properties
Complexity:
361
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
274.122g/mol
Formal Charge:
0
Heavy Atom Count:
21
Hydrogen Bond Acceptor Count:
2
Hydrogen Bond Donor Count:
1
Isotope Atom Count:
0
Molecular Weight:
274.327g/mol
Monoisotopic Mass:
274.122g/mol
Rotatable Bond Count:
2
Topological Polar Surface Area:
46.5A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
2.9
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