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Home > Imidazoles > 13269-91-5
13269-91-5 | 1H-Imidazole, 2,4,5-triphenyl-1-(phenylmethyl)-
CAS No: 13269-91-5 Catalog No: AG00110A MDL No:
Product Description
Catalog Number:
AG00110A
Chemical Name:
1H-Imidazole, 2,4,5-triphenyl-1-(phenylmethyl)-
CAS Number:
13269-91-5
Molecular Formula:
C28H22N2
Molecular Weight:
386.4877
IUPAC Name:
1-benzyl-2,4,5-triphenylimidazole
InChI:
InChI=1S/C28H22N2/c1-5-13-22(14-6-1)21-30-27(24-17-9-3-10-18-24)26(23-15-7-2-8-16-23)29-28(30)25-19-11-4-12-20-25/h1-20H,21H2
InChI Key:
YXISEDRBMZJRNY-UHFFFAOYSA-N
SMILES:
c1ccc(cc1)Cn1c(nc(c1c1ccccc1)c1ccccc1)c1ccccc1
Properties
Complexity:
495
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
386.178g/mol
Formal Charge:
0
Heavy Atom Count:
30
Hydrogen Bond Acceptor Count:
1
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
386.498g/mol
Monoisotopic Mass:
386.178g/mol
Rotatable Bond Count:
5
Topological Polar Surface Area:
17.8A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
6.6
Literature
| Title | Journal |
|---|---|
| Nuclear factor-kappaB mediated inhibition of cytokine production by imidazoline scaffolds. | Journal of medicinal chemistry 20090312 |
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