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Home > Imidazoles > 824394-85-6
824394-85-6 | 1H-Benzimidazole, 2-[2-(1H-imidazol-2-yl)phenyl]-4,5-dimethyl-
CAS No: 824394-85-6 Catalog No: AG004WN9 MDL No:
Product Description
Catalog Number:
AG004WN9
Chemical Name:
1H-Benzimidazole, 2-[2-(1H-imidazol-2-yl)phenyl]-4,5-dimethyl-
CAS Number:
824394-85-6
Molecular Formula:
C18H16N4
Molecular Weight:
288.3464
IUPAC Name:
2-[2-(1H-imidazol-2-yl)phenyl]-4,5-dimethyl-1H-benzimidazole
InChI:
InChI=1S/C18H16N4/c1-11-7-8-15-16(12(11)2)22-18(21-15)14-6-4-3-5-13(14)17-19-9-10-20-17/h3-10H,1-2H3,(H,19,20)(H,21,22)
InChI Key:
RDIVJSOADMBTNE-UHFFFAOYSA-N
SMILES:
Cc1ccc2c(c1C)nc([nH]2)c1ccccc1c1ncc[nH]1
Properties
Complexity:
387
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
288.137g/mol
Formal Charge:
0
Heavy Atom Count:
22
Hydrogen Bond Acceptor Count:
2
Hydrogen Bond Donor Count:
2
Isotope Atom Count:
0
Molecular Weight:
288.354g/mol
Monoisotopic Mass:
288.137g/mol
Rotatable Bond Count:
2
Topological Polar Surface Area:
57.4A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
3.7
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