5-(4-benzylphenyl)-2-(2-chloro-6-fluorophenyl)-1H-imidazole

C22H16ClFN2 — CID 52941240

IUPAC5-(4-benzylphenyl)-2-(2-chloro-6-fluorophenyl)-1H-imidazole
SMILESFc1cccc(Cl)c1-c1ncc(-c2ccc(Cc3ccccc3)cc2)[nH]1
InChIInChI=1S/C22H16ClFN2/c23-18-7-4-8-19(24)21(18)22-25-14-20(26-22)17-11-9-16(10-12-17)13-15-5-2-1-3-6-15/h1-12,14H,13H2,(H,25,26)
InChIKeyQYJAWUPQJQNQMO-UHFFFAOYSA-N
MW362.84 g/mol
LogP6.13
Rot. Bonds4

About 5-(4-benzylphenyl)-2-(2-chloro-6-fluorophenyl)-1H-imidazole

5-(4-benzylphenyl)-2-(2-chloro-6-fluorophenyl)-1H-imidazole (PubChem CID 52941240) has the molecular formula C22H16ClFN2 and a molecular weight of 362.84 g/mol. Its IUPAC name is 5-(4-benzylphenyl)-2-(2-chloro-6-fluorophenyl)-1H-imidazole.

Molecular Properties

Compound Name5-(4-benzylphenyl)-2-(2-chloro-6-fluorophenyl)-1H-imidazole
PubChem CID52941240
Molecular FormulaC22H16ClFN2
Molecular Weight362.84 g/mol
Exact Mass362.10
IUPAC Name5-(4-benzylphenyl)-2-(2-chloro-6-fluorophenyl)-1H-imidazole
SMILESFc1cccc(Cl)c1-c1ncc(-c2ccc(Cc3ccccc3)cc2)[nH]1
InChIInChI=1S/C22H16ClFN2/c23-18-7-4-8-19(24)21(18)22-25-14-20(26-22)17-11-9-16(10-12-17)13-15-5-2-1-3-6-15/h1-12,14H,13H2,(H,25,26)
InChIKeyQYJAWUPQJQNQMO-UHFFFAOYSA-N
XLogP6.13
TPSA28.68 Ų
H-Bond Donors1
H-Bond Acceptors1
Rotatable Bonds4
Heavy Atoms26
Complexity—

Lipinski Rule of Five

1 violation

RuleValue
MW ≤ 500362.84
LogP ≤ 56.13
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 101

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Related Compounds

4-[2-[4-[2-(2-chloro-6-fluorophenyl)-1H-imidazol-5-yl]phenyl]ethynyl]benzoic acid
CID 52946057
4-[2-[4-[2-(2-chloro-6-fluorophenyl)-1H-imidazol-5-yl]phenyl]ethynyl]benzenesulfonamide
CID 52942553
5-[2-(2-chloro-6-fluorophenyl)-1H-imidazol-5-yl]-2-(2-cyclopropylethynyl)pyridine
CID 52948776
3-[5-[2-(2-chloro-6-fluorophenyl)-1H-imidazol-5-yl]-2-pyridinyl]-5-cyclopentyl-1,2,4-oxadiazole
CID 68791665
2-(3,4-dichlorophenyl)-5-phenyl-1H-imidazole
CID 23103021
2-(5-chloro-2-methylnaphthalen-1-yl)-5-(4-hexylphenyl)-1H-imidazole
CID 141189854
2-[2-(2-chloro-6-fluorophenyl)-1H-imidazol-5-yl]-1-benzofuran-5-carboxylic acid
CID 68789188
2-(2-chloro-6-fluorophenyl)-4-(6-phenyl-3-pyridinyl)-1H-imidazole-5-carboxylic acid
CID 70833482
3-methyl-2-(5-phenyl-1H-imidazol-2-yl)aniline
CID 61394643
1-chloro-3-fluoro-2-(4-fluorophenyl)benzene
CID 57094846
5-(2,6-dichlorophenyl)-2-(1H-pyrrol-2-yl)-1H-imidazole
CID 150674628
4-[2-(4-chloro-3-fluorophenyl)-1H-imidazol-5-yl]-N-methylaniline
CID 131992559

Frequently Asked Questions

What is the IUPAC name of 5-(4-benzylphenyl)-2-(2-chloro-6-fluorophenyl)-1H-imidazole?
The IUPAC name of 5-(4-benzylphenyl)-2-(2-chloro-6-fluorophenyl)-1H-imidazole (CID 52941240) is 5-(4-benzylphenyl)-2-(2-chloro-6-fluorophenyl)-1H-imidazole.
What is the SMILES notation for 5-(4-benzylphenyl)-2-(2-chloro-6-fluorophenyl)-1H-imidazole?
The canonical SMILES for 5-(4-benzylphenyl)-2-(2-chloro-6-fluorophenyl)-1H-imidazole is Fc1cccc(Cl)c1-c1ncc(-c2ccc(Cc3ccccc3)cc2)[nH]1.
What is the InChIKey of 5-(4-benzylphenyl)-2-(2-chloro-6-fluorophenyl)-1H-imidazole?
The InChIKey is QYJAWUPQJQNQMO-UHFFFAOYSA-N. The full InChI is InChI=1S/C22H16ClFN2/c23-18-7-4-8-19(24)21(18)22-25-14-20(26-22)17-11-9-16(10-12-17)13-15-5-2-1-3-6-15/h1-12,14H,13H2,(H,25,26).
What are the key properties of 5-(4-benzylphenyl)-2-(2-chloro-6-fluorophenyl)-1H-imidazole?
5-(4-benzylphenyl)-2-(2-chloro-6-fluorophenyl)-1H-imidazole has a molecular weight of 362.84 g/mol, XLogP of 6.13, 4 rotatable bonds, 1 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for 5-(4-benzylphenyl)-2-(2-chloro-6-fluorophenyl)-1H-imidazole is sourced from PubChem (CID 52941240), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).