2-(4-fluorophenyl)-1,4,5-triphenylimidazole

C27H19FN2 — CID 90686948

IUPAC2-(4-fluorophenyl)-1,4,5-triphenylimidazole
SMILESFc1ccc(-c2nc(-c3ccccc3)c(-c3ccccc3)n2-c2ccccc2)cc1
InChIInChI=1S/C27H19FN2/c28-23-18-16-22(17-19-23)27-29-25(20-10-4-1-5-11-20)26(21-12-6-2-7-13-21)30(27)24-14-8-3-9-15-24/h1-19H
InChIKeyBZXPHQCABCBSHX-UHFFFAOYSA-N
MW390.46 g/mol
LogP7.01
Rot. Bonds4

About 2-(4-fluorophenyl)-1,4,5-triphenylimidazole

2-(4-fluorophenyl)-1,4,5-triphenylimidazole (PubChem CID 90686948) has the molecular formula C27H19FN2 and a molecular weight of 390.46 g/mol. Its IUPAC name is 2-(4-fluorophenyl)-1,4,5-triphenylimidazole.

Molecular Properties

Compound Name2-(4-fluorophenyl)-1,4,5-triphenylimidazole
PubChem CID90686948
Molecular FormulaC27H19FN2
Molecular Weight390.46 g/mol
Exact Mass390.15
IUPAC Name2-(4-fluorophenyl)-1,4,5-triphenylimidazole
SMILESFc1ccc(-c2nc(-c3ccccc3)c(-c3ccccc3)n2-c2ccccc2)cc1
InChIInChI=1S/C27H19FN2/c28-23-18-16-22(17-19-23)27-29-25(20-10-4-1-5-11-20)26(21-12-6-2-7-13-21)30(27)24-14-8-3-9-15-24/h1-19H
InChIKeyBZXPHQCABCBSHX-UHFFFAOYSA-N
XLogP7.01
TPSA17.82 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds4
Heavy Atoms30
Complexity—

Lipinski Rule of Five

1 violation

RuleValue
MW ≤ 500390.46
LogP ≤ 57.01
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-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
1-(4-Methylbenzyl)-2-(4-methylphenyl)-1h-benzimidazole
CID 15552557
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)-1,4,5-triphenylimidazole?
The IUPAC name of 2-(4-fluorophenyl)-1,4,5-triphenylimidazole (CID 90686948) is 2-(4-fluorophenyl)-1,4,5-triphenylimidazole.
What is the SMILES notation for 2-(4-fluorophenyl)-1,4,5-triphenylimidazole?
The canonical SMILES for 2-(4-fluorophenyl)-1,4,5-triphenylimidazole is Fc1ccc(-c2nc(-c3ccccc3)c(-c3ccccc3)n2-c2ccccc2)cc1.
What is the InChIKey of 2-(4-fluorophenyl)-1,4,5-triphenylimidazole?
The InChIKey is BZXPHQCABCBSHX-UHFFFAOYSA-N. The full InChI is InChI=1S/C27H19FN2/c28-23-18-16-22(17-19-23)27-29-25(20-10-4-1-5-11-20)26(21-12-6-2-7-13-21)30(27)24-14-8-3-9-15-24/h1-19H.
What are the key properties of 2-(4-fluorophenyl)-1,4,5-triphenylimidazole?
2-(4-fluorophenyl)-1,4,5-triphenylimidazole has a molecular weight of 390.46 g/mol, XLogP of 7.01, 4 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(4-fluorophenyl)-1,4,5-triphenylimidazole is sourced from PubChem (CID 90686948), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).