1-benzyl-2-dibenzofuran-4-ylbenzimidazole

C26H18N2O — CID 156657134

IUPAC1-benzyl-2-dibenzofuran-4-ylbenzimidazole
SMILESc1ccc(Cn2c(-c3cccc4c3oc3ccccc34)nc3ccccc32)cc1
InChIInChI=1S/C26H18N2O/c1-2-9-18(10-3-1)17-28-23-15-6-5-14-22(23)27-26(28)21-13-8-12-20-19-11-4-7-16-24(19)29-25(20)21/h1-16H,17H2
InChIKeyLPPXAAVDJOAOGZ-UHFFFAOYSA-N
MW374.44 g/mol
LogP6.65
Rot. Bonds3

About 1-benzyl-2-dibenzofuran-4-ylbenzimidazole

1-benzyl-2-dibenzofuran-4-ylbenzimidazole (PubChem CID 156657134) has the molecular formula C26H18N2O and a molecular weight of 374.44 g/mol. Its IUPAC name is 1-benzyl-2-dibenzofuran-4-ylbenzimidazole.

Molecular Properties

Compound Name1-benzyl-2-dibenzofuran-4-ylbenzimidazole
PubChem CID156657134
Molecular FormulaC26H18N2O
Molecular Weight374.44 g/mol
Exact Mass374.14
IUPAC Name1-benzyl-2-dibenzofuran-4-ylbenzimidazole
SMILESc1ccc(Cn2c(-c3cccc4c3oc3ccccc34)nc3ccccc32)cc1
InChIInChI=1S/C26H18N2O/c1-2-9-18(10-3-1)17-28-23-15-6-5-14-22(23)27-26(28)21-13-8-12-20-19-11-4-7-16-24(19)29-25(20)21/h1-16H,17H2
InChIKeyLPPXAAVDJOAOGZ-UHFFFAOYSA-N
XLogP6.65
TPSA30.96 Ų
H-Bond Donors
H-Bond Acceptors3
Rotatable Bonds3
Heavy Atoms29
Complexity—

Lipinski Rule of Five

1 violation

RuleValue
MW ≤ 500374.44
LogP ≤ 56.65
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 103

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Related Compounds

8-(1-benzylbenzimidazol-2-yl)-2-methyl-[1]benzofuro[2,3-b]pyridine
CID 156667552
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CID 58309516
8-(1-benzylbenzimidazol-2-yl)-5-methyl-[1]benzofuro[2,3-b]pyridine
CID 156669661
2-dibenzofuran-4-yl-1-(3-methylnaphthalen-2-yl)benzimidazole
CID 167339079
[dideuterio-[2-(2-dibenzofuran-4-ylbenzimidazol-1-yl)phenyl]methyl]-trimethylsilane
CID 168730895
2-(4-dibenzofuran-4-yl-2,5-dimethylphenyl)-1-phenylbenzimidazole
CID 58309657
2-dibenzofuran-4-yl-1-(2-phenyl-6-propan-2-ylphenyl)benzimidazole
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2-dibenzofuran-4-yl-3-phenylimidazo[4,5-c]pyridine
CID 156658408
2-dibenzofuran-4-yl-1-(9H-fluoren-1-yl)benzimidazole
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2,4,6-tris(1-benzylbenzimidazol-2-yl)phenol
CID 139146415
[4-[[2-(2-methylphenyl)benzimidazol-1-yl]methyl]phenyl]methanamine
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CID 17002114

Frequently Asked Questions

What is the IUPAC name of 1-benzyl-2-dibenzofuran-4-ylbenzimidazole?
The IUPAC name of 1-benzyl-2-dibenzofuran-4-ylbenzimidazole (CID 156657134) is 1-benzyl-2-dibenzofuran-4-ylbenzimidazole.
What is the SMILES notation for 1-benzyl-2-dibenzofuran-4-ylbenzimidazole?
The canonical SMILES for 1-benzyl-2-dibenzofuran-4-ylbenzimidazole is c1ccc(Cn2c(-c3cccc4c3oc3ccccc34)nc3ccccc32)cc1.
What is the InChIKey of 1-benzyl-2-dibenzofuran-4-ylbenzimidazole?
The InChIKey is LPPXAAVDJOAOGZ-UHFFFAOYSA-N. The full InChI is InChI=1S/C26H18N2O/c1-2-9-18(10-3-1)17-28-23-15-6-5-14-22(23)27-26(28)21-13-8-12-20-19-11-4-7-16-24(19)29-25(20)21/h1-16H,17H2.
What are the key properties of 1-benzyl-2-dibenzofuran-4-ylbenzimidazole?
1-benzyl-2-dibenzofuran-4-ylbenzimidazole has a molecular weight of 374.44 g/mol, XLogP of 6.65, 3 rotatable bonds, 0 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 1-benzyl-2-dibenzofuran-4-ylbenzimidazole is sourced from PubChem (CID 156657134), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).