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100558-20-1 | 1H-Imidazole, 2-(4-chlorophenyl)-5-phenyl-
CAS No: 100558-20-1 Catalog No: AG0002BS MDL No:
Product Description
Catalog Number:
AG0002BS
Chemical Name:
1H-Imidazole, 2-(4-chlorophenyl)-5-phenyl-
CAS Number:
100558-20-1
Molecular Formula:
C15H11ClN2
Molecular Weight:
254.7142
IUPAC Name:
2-(4-chlorophenyl)-5-phenyl-1H-imidazole
InChI:
InChI=1S/C15H11ClN2/c16-13-8-6-12(7-9-13)15-17-10-14(18-15)11-4-2-1-3-5-11/h1-10H,(H,17,18)
InChI Key:
RYAFXUYSBDAZBC-UHFFFAOYSA-N
SMILES:
Clc1ccc(cc1)c1ncc([nH]1)c1ccccc1
Properties
Complexity:
257
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
254.061g/mol
Formal Charge:
0
Heavy Atom Count:
18
Hydrogen Bond Acceptor Count:
1
Hydrogen Bond Donor Count:
1
Isotope Atom Count:
0
Molecular Weight:
254.717g/mol
Monoisotopic Mass:
254.061g/mol
Rotatable Bond Count:
2
Topological Polar Surface Area:
28.7A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
4
Literature
| Title | Journal |
|---|---|
| 2,4(5)-diarylimidazoles as inhibitors of hNaV1.2 sodium channels: pharmacological evaluation and structure-property relationships. | Bioorganic & medicinal chemistry 20090515 |
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