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Home > Imidazoles > 824428-64-0
824428-64-0 | Methanone, [6-methoxy-1-(3-methylbutyl)-1H-benzimidazol-2-yl]phenyl-
CAS No: 824428-64-0 Catalog No: AG00512Y MDL No:
Product Description
Catalog Number:
AG00512Y
Chemical Name:
Methanone, [6-methoxy-1-(3-methylbutyl)-1H-benzimidazol-2-yl]phenyl-
CAS Number:
824428-64-0
Molecular Formula:
C20H22N2O2
Molecular Weight:
322.4009
IUPAC Name:
[6-methoxy-1-(3-methylbutyl)benzimidazol-2-yl]-phenylmethanone
InChI:
InChI=1S/C20H22N2O2/c1-14(2)11-12-22-18-13-16(24-3)9-10-17(18)21-20(22)19(23)15-7-5-4-6-8-15/h4-10,13-14H,11-12H2,1-3H3
InChI Key:
GTIMDMMEDLYHST-UHFFFAOYSA-N
SMILES:
COc1ccc2c(c1)n(CCC(C)C)c(n2)C(=O)c1ccccc1
Properties
Complexity:
420
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
322.168g/mol
Formal Charge:
0
Heavy Atom Count:
24
Hydrogen Bond Acceptor Count:
3
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
322.408g/mol
Monoisotopic Mass:
322.168g/mol
Rotatable Bond Count:
6
Topological Polar Surface Area:
44.1A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
4.7
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