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Home > Imidazoles > 169155-33-3
169155-33-3 | 1H-Imidazole, 4,5-bis(4-methylphenyl)-2-(4-nitrophenyl)-
CAS No: 169155-33-3 Catalog No: AG001YJ9 MDL No:
Product Description
Catalog Number:
AG001YJ9
Chemical Name:
1H-Imidazole, 4,5-bis(4-methylphenyl)-2-(4-nitrophenyl)-
CAS Number:
169155-33-3
Molecular Formula:
C23H19N3O2
Molecular Weight:
369.4159
IUPAC Name:
4,5-bis(4-methylphenyl)-2-(4-nitrophenyl)-1H-imidazole
InChI:
InChI=1S/C23H19N3O2/c1-15-3-7-17(8-4-15)21-22(18-9-5-16(2)6-10-18)25-23(24-21)19-11-13-20(14-12-19)26(27)28/h3-14H,1-2H3,(H,24,25)
InChI Key:
NABGIIGYLCLPNZ-UHFFFAOYSA-N
SMILES:
Cc1ccc(cc1)c1[nH]c(nc1c1ccc(cc1)C)c1ccc(cc1)[N+](=O)[O-]
Properties
Complexity:
512
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
369.148g/mol
Formal Charge:
0
Heavy Atom Count:
28
Hydrogen Bond Acceptor Count:
3
Hydrogen Bond Donor Count:
1
Isotope Atom Count:
0
Molecular Weight:
369.424g/mol
Monoisotopic Mass:
369.148g/mol
Rotatable Bond Count:
3
Topological Polar Surface Area:
74.5A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
5.6
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