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Home > Imidazoles > 824428-65-1
824428-65-1 | Methanone, [1-(2-ethylbutyl)-6-methoxy-1H-benzimidazol-2-yl]phenyl-
CAS No: 824428-65-1 Catalog No: AG00512X MDL No:
Product Description
Catalog Number:
AG00512X
Chemical Name:
Methanone, [1-(2-ethylbutyl)-6-methoxy-1H-benzimidazol-2-yl]phenyl-
CAS Number:
824428-65-1
Molecular Formula:
C21H24N2O2
Molecular Weight:
336.4275
IUPAC Name:
[1-(2-ethylbutyl)-6-methoxybenzimidazol-2-yl]-phenylmethanone
InChI:
InChI=1S/C21H24N2O2/c1-4-15(5-2)14-23-19-13-17(25-3)11-12-18(19)22-21(23)20(24)16-9-7-6-8-10-16/h6-13,15H,4-5,14H2,1-3H3
InChI Key:
VIPCEYGEJUJKET-UHFFFAOYSA-N
SMILES:
CCC(Cn1c(nc2c1cc(OC)cc2)C(=O)c1ccccc1)CC
Properties
Complexity:
432
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
336.184g/mol
Formal Charge:
0
Heavy Atom Count:
25
Hydrogen Bond Acceptor Count:
3
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
336.435g/mol
Monoisotopic Mass:
336.184g/mol
Rotatable Bond Count:
7
Topological Polar Surface Area:
44.1A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
5.1
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