2-(4-chlorophenyl)-4-(fluoromethyl)-1-(4-methylsulfonylphenyl)imidazole

C17H14ClFN2O2S — CID 11793188

IUPAC2-(4-chlorophenyl)-4-(fluoromethyl)-1-(4-methylsulfonylphenyl)imidazole
SMILESCS(=O)(=O)c1ccc(-n2cc(CF)nc2-c2ccc(Cl)cc2)cc1
InChIInChI=1S/C17H14ClFN2O2S/c1-24(22,23)16-8-6-15(7-9-16)21-11-14(10-19)20-17(21)12-2-4-13(18)5-3-12/h2-9,11H,10H2,1H3
InChIKeyNRJOYHYYECHFEN-UHFFFAOYSA-N
MW364.83 g/mol
LogP4.07
Rot. Bonds4

About 2-(4-chlorophenyl)-4-(fluoromethyl)-1-(4-methylsulfonylphenyl)imidazole

2-(4-chlorophenyl)-4-(fluoromethyl)-1-(4-methylsulfonylphenyl)imidazole (PubChem CID 11793188) has the molecular formula C17H14ClFN2O2S and a molecular weight of 364.83 g/mol. Its IUPAC name is 2-(4-chlorophenyl)-4-(fluoromethyl)-1-(4-methylsulfonylphenyl)imidazole.

Molecular Properties

Compound Name2-(4-chlorophenyl)-4-(fluoromethyl)-1-(4-methylsulfonylphenyl)imidazole
PubChem CID11793188
Molecular FormulaC17H14ClFN2O2S
Molecular Weight364.83 g/mol
Exact Mass364.04
IUPAC Name2-(4-chlorophenyl)-4-(fluoromethyl)-1-(4-methylsulfonylphenyl)imidazole
SMILESCS(=O)(=O)c1ccc(-n2cc(CF)nc2-c2ccc(Cl)cc2)cc1
InChIInChI=1S/C17H14ClFN2O2S/c1-24(22,23)16-8-6-15(7-9-16)21-11-14(10-19)20-17(21)12-2-4-13(18)5-3-12/h2-9,11H,10H2,1H3
InChIKeyNRJOYHYYECHFEN-UHFFFAOYSA-N
XLogP4.07
TPSA51.96 Ų
H-Bond Donors
H-Bond Acceptors4
Rotatable Bonds4
Heavy Atoms24
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500364.83
LogP ≤ 54.07
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 104

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Related Compounds

2-(4-Chlorophenyl)-4-methyl-1-(4-(methylsulfonyl)phenyl)-1H-imidazole
CID 9946200
3-(4-Chloro-phenyl)-1-(4-difluoromethylsulfanyl-phenyl)-6,7-dihydro-5H-pyrrolo[1,2-a]imidazol-1-ium
CID 12005569
4-[2-(3-Chloro-phenyl)-4-trifluoromethyl-imidazol-1-yl]-benzenesulfonamide
CID 9801204
2-(3-Chloro-phenyl)-1-(4-methanesulfonyl-phenyl)-4-trifluoromethyl-1H-imidazole
CID 9822332
3-[1-[4-(methylsulfonyl)phenyl]-4-trifluoromethyl-1H-imidazol-2-yl]pyridine
CID 9929140
1-(4-(methylsulfonyl)phenyl]-2-phenyl-4-trifluoromethyl-1H-imidazole
CID 9947305
2-[1-[4-(methylsulfonyl)phenyl]-4-trifluoromethyl-1H-imidazol-2-yl]pyridine
CID 9947371
4-[5-(4-Fluorophenyl)-3-(4-methylsulfinylphenyl)imidazol-4-yl]pyridine
CID 10091003
4-Chloro-5-(4-isopropyl-phenyl)-1-(4-methanesulfonyl-phenyl)-1H-imidazole
CID 10109982
1-(4-Methanesulfonyl-phenyl)-2-m-tolyl-4-trifluoromethyl-1H-imidazole
CID 10110298
4-Chloro-5-(3,5-difluoro-phenyl)-1-(4-methanesulfonyl-phenyl)-1H-imidazole
CID 10133653
4-(2-p-Tolyl-4-trifluoromethyl-imidazol-1-yl)-benzenesulfonamide
CID 10134425

Frequently Asked Questions

What is the IUPAC name of 2-(4-chlorophenyl)-4-(fluoromethyl)-1-(4-methylsulfonylphenyl)imidazole?
The IUPAC name of 2-(4-chlorophenyl)-4-(fluoromethyl)-1-(4-methylsulfonylphenyl)imidazole (CID 11793188) is 2-(4-chlorophenyl)-4-(fluoromethyl)-1-(4-methylsulfonylphenyl)imidazole.
What is the SMILES notation for 2-(4-chlorophenyl)-4-(fluoromethyl)-1-(4-methylsulfonylphenyl)imidazole?
The canonical SMILES for 2-(4-chlorophenyl)-4-(fluoromethyl)-1-(4-methylsulfonylphenyl)imidazole is CS(=O)(=O)c1ccc(-n2cc(CF)nc2-c2ccc(Cl)cc2)cc1.
What is the InChIKey of 2-(4-chlorophenyl)-4-(fluoromethyl)-1-(4-methylsulfonylphenyl)imidazole?
The InChIKey is NRJOYHYYECHFEN-UHFFFAOYSA-N. The full InChI is InChI=1S/C17H14ClFN2O2S/c1-24(22,23)16-8-6-15(7-9-16)21-11-14(10-19)20-17(21)12-2-4-13(18)5-3-12/h2-9,11H,10H2,1H3.
What are the key properties of 2-(4-chlorophenyl)-4-(fluoromethyl)-1-(4-methylsulfonylphenyl)imidazole?
2-(4-chlorophenyl)-4-(fluoromethyl)-1-(4-methylsulfonylphenyl)imidazole has a molecular weight of 364.83 g/mol, XLogP of 4.07, 4 rotatable bonds, 0 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(4-chlorophenyl)-4-(fluoromethyl)-1-(4-methylsulfonylphenyl)imidazole is sourced from PubChem (CID 11793188), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).