2-(4-fluorophenyl)-1-(3-methylphenyl)-4,5-diphenylimidazole

C28H21FN2 — CID 139218784

IUPAC2-(4-fluorophenyl)-1-(3-methylphenyl)-4,5-diphenylimidazole
SMILESCc1cccc(-n2c(-c3ccc(F)cc3)nc(-c3ccccc3)c2-c2ccccc2)c1
InChIInChI=1S/C28H21FN2/c1-20-9-8-14-25(19-20)31-27(22-12-6-3-7-13-22)26(21-10-4-2-5-11-21)30-28(31)23-15-17-24(29)18-16-23/h2-19H,1H3
InChIKeyJIWUXNIWRZKWCI-UHFFFAOYSA-N
MW404.49 g/mol
LogP7.32
Rot. Bonds4

About 2-(4-fluorophenyl)-1-(3-methylphenyl)-4,5-diphenylimidazole

2-(4-fluorophenyl)-1-(3-methylphenyl)-4,5-diphenylimidazole (PubChem CID 139218784) has the molecular formula C28H21FN2 and a molecular weight of 404.49 g/mol. Its IUPAC name is 2-(4-fluorophenyl)-1-(3-methylphenyl)-4,5-diphenylimidazole.

Molecular Properties

Compound Name2-(4-fluorophenyl)-1-(3-methylphenyl)-4,5-diphenylimidazole
PubChem CID139218784
Molecular FormulaC28H21FN2
Molecular Weight404.49 g/mol
Exact Mass404.17
IUPAC Name2-(4-fluorophenyl)-1-(3-methylphenyl)-4,5-diphenylimidazole
SMILESCc1cccc(-n2c(-c3ccc(F)cc3)nc(-c3ccccc3)c2-c2ccccc2)c1
InChIInChI=1S/C28H21FN2/c1-20-9-8-14-25(19-20)31-27(22-12-6-3-7-13-22)26(21-10-4-2-5-11-21)30-28(31)23-15-17-24(29)18-16-23/h2-19H,1H3
InChIKeyJIWUXNIWRZKWCI-UHFFFAOYSA-N
XLogP7.32
TPSA17.82 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds4
Heavy Atoms31
Complexity—

Lipinski Rule of Five

1 violation

RuleValue
MW ≤ 500404.49
LogP ≤ 57.32
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 102

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Related Compounds

2,4,5-Triphenylimidazole
CID 10232
1H-Benzimidazole, 2-(2,6-difluorophenyl)-1-((2,6-difluorophenyl)methyl)-
CID 468847
1-(2,6-Difluorobenzyl)-2-(2,6-difluorophenyl)-4-methyl-1h-benzimidazole
CID 468848
1-(2,6-Difluorobenzyl)-2-(2,6-difluorophenyl)-4-ethylbenzimidazole
CID 492674
4-(4,5-Diphenyl-1H-imidazol-2-yl)-N,N-dimethylaniline
CID 237339
1,2-dibenzyl-1H-1,3-benzodiazole
CID 1350539
1-Benzyl-2-phenylbenzimidazole
CID 1221687
1H-Benzimidazole, 1-((2,6-difluorophenyl)methyl)-2-phenyl-
CID 468840
1H-Benzimidazole, 2-(2,6-difluorophenyl)-4-methyl-1-(phenylmethyl)-
CID 468856
2-(4-Fluorophenyl)-1-methylbenzimidazole
CID 614526
2-(4-fluorophenyl)-4,5-diphenyl-1H-imidazole
CID 800028
2-(2,6-difluorophenyl)-N-(2,6-dimethylphenyl)-5-methylimidazo[1,2-a]pyridin-3-amine
CID 59579045

Frequently Asked Questions

What is the IUPAC name of 2-(4-fluorophenyl)-1-(3-methylphenyl)-4,5-diphenylimidazole?
The IUPAC name of 2-(4-fluorophenyl)-1-(3-methylphenyl)-4,5-diphenylimidazole (CID 139218784) is 2-(4-fluorophenyl)-1-(3-methylphenyl)-4,5-diphenylimidazole.
What is the SMILES notation for 2-(4-fluorophenyl)-1-(3-methylphenyl)-4,5-diphenylimidazole?
The canonical SMILES for 2-(4-fluorophenyl)-1-(3-methylphenyl)-4,5-diphenylimidazole is Cc1cccc(-n2c(-c3ccc(F)cc3)nc(-c3ccccc3)c2-c2ccccc2)c1.
What is the InChIKey of 2-(4-fluorophenyl)-1-(3-methylphenyl)-4,5-diphenylimidazole?
The InChIKey is JIWUXNIWRZKWCI-UHFFFAOYSA-N. The full InChI is InChI=1S/C28H21FN2/c1-20-9-8-14-25(19-20)31-27(22-12-6-3-7-13-22)26(21-10-4-2-5-11-21)30-28(31)23-15-17-24(29)18-16-23/h2-19H,1H3.
What are the key properties of 2-(4-fluorophenyl)-1-(3-methylphenyl)-4,5-diphenylimidazole?
2-(4-fluorophenyl)-1-(3-methylphenyl)-4,5-diphenylimidazole has a molecular weight of 404.49 g/mol, XLogP of 7.32, 4 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(4-fluorophenyl)-1-(3-methylphenyl)-4,5-diphenylimidazole is sourced from PubChem (CID 139218784), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).