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Home > Imidazoles > 125701-97-5
125701-97-5 | 1H-Imidazole, 2-(2,4-dimethylphenyl)-4,5-bis(4-methoxyphenyl)-
CAS No: 125701-97-5 Catalog No: AG000OHV MDL No:
Product Description
Catalog Number:
AG000OHV
Chemical Name:
1H-Imidazole, 2-(2,4-dimethylphenyl)-4,5-bis(4-methoxyphenyl)-
CAS Number:
125701-97-5
Molecular Formula:
C25H24N2O2
Molecular Weight:
384.4703
IUPAC Name:
2-(2,4-dimethylphenyl)-4,5-bis(4-methoxyphenyl)-1H-imidazole
InChI:
InChI=1S/C25H24N2O2/c1-16-5-14-22(17(2)15-16)25-26-23(18-6-10-20(28-3)11-7-18)24(27-25)19-8-12-21(29-4)13-9-19/h5-15H,1-4H3,(H,26,27)
InChI Key:
GIFQPRNMCCHFRS-UHFFFAOYSA-N
SMILES:
COc1ccc(cc1)c1[nH]c(nc1c1ccc(cc1)OC)c1ccc(cc1C)C
Properties
Complexity:
499
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
384.184g/mol
Formal Charge:
0
Heavy Atom Count:
29
Hydrogen Bond Acceptor Count:
3
Hydrogen Bond Donor Count:
1
Isotope Atom Count:
0
Molecular Weight:
384.479g/mol
Monoisotopic Mass:
384.184g/mol
Rotatable Bond Count:
5
Topological Polar Surface Area:
47.1A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
5.7
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