2-(1-fluorodibenzofuran-4-yl)-1-(2-phenylphenyl)benzimidazole

C31H19FN2O — CID 156659191

IUPAC2-(1-fluorodibenzofuran-4-yl)-1-(2-phenylphenyl)benzimidazole
SMILESFc1ccc(-c2nc3ccccc3n2-c2ccccc2-c2ccccc2)c2oc3ccccc3c12
InChIInChI=1S/C31H19FN2O/c32-24-19-18-23(30-29(24)22-13-5-9-17-28(22)35-30)31-33-25-14-6-8-16-27(25)34(31)26-15-7-4-12-21(26)20-10-2-1-3-11-20/h1-19H
InChIKeySEXKNQZVRICHPB-UHFFFAOYSA-N
MW454.50 g/mol
LogP8.40
Rot. Bonds3

About 2-(1-fluorodibenzofuran-4-yl)-1-(2-phenylphenyl)benzimidazole

2-(1-fluorodibenzofuran-4-yl)-1-(2-phenylphenyl)benzimidazole (PubChem CID 156659191) has the molecular formula C31H19FN2O and a molecular weight of 454.50 g/mol. Its IUPAC name is 2-(1-fluorodibenzofuran-4-yl)-1-(2-phenylphenyl)benzimidazole.

Molecular Properties

Compound Name2-(1-fluorodibenzofuran-4-yl)-1-(2-phenylphenyl)benzimidazole
PubChem CID156659191
Molecular FormulaC31H19FN2O
Molecular Weight454.50 g/mol
Exact Mass454.15
IUPAC Name2-(1-fluorodibenzofuran-4-yl)-1-(2-phenylphenyl)benzimidazole
SMILESFc1ccc(-c2nc3ccccc3n2-c2ccccc2-c2ccccc2)c2oc3ccccc3c12
InChIInChI=1S/C31H19FN2O/c32-24-19-18-23(30-29(24)22-13-5-9-17-28(22)35-30)31-33-25-14-6-8-16-27(25)34(31)26-15-7-4-12-21(26)20-10-2-1-3-11-20/h1-19H
InChIKeySEXKNQZVRICHPB-UHFFFAOYSA-N
XLogP8.40
TPSA30.96 Ų
H-Bond Donors
H-Bond Acceptors3
Rotatable Bonds3
Heavy Atoms35
Complexity—

Lipinski Rule of Five

1 violation

RuleValue
MW ≤ 500454.50
LogP ≤ 58.40
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 103

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Related Compounds

2-(9-fluorodibenzofuran-4-yl)-1-naphthalen-1-ylbenzimidazole
CID 156658241
1-dibenzofuran-4-yl-2-[1-[4-(trideuteriomethyl)phenyl]dibenzofuran-4-yl]benzimidazole
CID 156657603
2-(1-fluoro-7-phenyldibenzofuran-4-yl)-1-[4-(4-phenylphenyl)-2,6-di(propan-2-yl)phenyl]benzimidazole
CID 169299441
2-phenyl-8-[1-(2-phenylphenyl)benzimidazol-2-yl]-[1]benzofuro[2,3-b]pyridine
CID 156670352
2-dibenzofuran-4-yl-1-(2-phenyl-6-propan-2-ylphenyl)benzimidazole
CID 167356370
2-(1-fluorodibenzofuran-4-yl)-6-methyl-1-phenylimidazo[4,5-c]pyridine
CID 164825457
2-dibenzofuran-4-yl-1-(3-methylnaphthalen-2-yl)benzimidazole
CID 167339079
2-(1-fluorodibenzofuran-4-yl)-4-methyl-1-phenylimidazo[4,5-c]quinoline
CID 164826690
8-(1-dibenzofuran-1-ylbenzimidazol-2-yl)-[1]benzofuro[2,3-b]pyridine
CID 156669158
8-[1-(4-phenyldibenzofuran-1-yl)benzimidazol-2-yl]-2-(trideuteriomethyl)-[1]benzothiolo[2,3-b]pyridine
CID 176756373
2-dibenzofuran-4-yl-1-(9H-fluoren-1-yl)benzimidazole
CID 167355258
2-(10-oxapentacyclo[11.8.0.03,11.04,9.014,19]henicosa-1,3(11),4(9),5,7,12,14,16,18,20-decaen-6-yl)-1-(2-phenylphenyl)benzimidazole
CID 156657587

Frequently Asked Questions

What is the IUPAC name of 2-(1-fluorodibenzofuran-4-yl)-1-(2-phenylphenyl)benzimidazole?
The IUPAC name of 2-(1-fluorodibenzofuran-4-yl)-1-(2-phenylphenyl)benzimidazole (CID 156659191) is 2-(1-fluorodibenzofuran-4-yl)-1-(2-phenylphenyl)benzimidazole.
What is the SMILES notation for 2-(1-fluorodibenzofuran-4-yl)-1-(2-phenylphenyl)benzimidazole?
The canonical SMILES for 2-(1-fluorodibenzofuran-4-yl)-1-(2-phenylphenyl)benzimidazole is Fc1ccc(-c2nc3ccccc3n2-c2ccccc2-c2ccccc2)c2oc3ccccc3c12.
What is the InChIKey of 2-(1-fluorodibenzofuran-4-yl)-1-(2-phenylphenyl)benzimidazole?
The InChIKey is SEXKNQZVRICHPB-UHFFFAOYSA-N. The full InChI is InChI=1S/C31H19FN2O/c32-24-19-18-23(30-29(24)22-13-5-9-17-28(22)35-30)31-33-25-14-6-8-16-27(25)34(31)26-15-7-4-12-21(26)20-10-2-1-3-11-20/h1-19H.
What are the key properties of 2-(1-fluorodibenzofuran-4-yl)-1-(2-phenylphenyl)benzimidazole?
2-(1-fluorodibenzofuran-4-yl)-1-(2-phenylphenyl)benzimidazole has a molecular weight of 454.50 g/mol, XLogP of 8.40, 3 rotatable bonds, 0 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(1-fluorodibenzofuran-4-yl)-1-(2-phenylphenyl)benzimidazole is sourced from PubChem (CID 156659191), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).