8-(1-dibenzofuran-1-ylbenzimidazol-2-yl)-[1]benzofuro[2,3-b]pyridine

C30H17N3O2 — CID 156669158

IUPAC8-(1-dibenzofuran-1-ylbenzimidazol-2-yl)-[1]benzofuro[2,3-b]pyridine
SMILESc1ccc2c(c1)nc(-c1cccc3c1oc1ncccc13)n2-c1cccc2oc3ccccc3c12
InChIInChI=1S/C30H17N3O2/c1-4-15-25-20(8-1)27-24(14-6-16-26(27)34-25)33-23-13-3-2-12-22(23)32-29(33)21-10-5-9-18-19-11-7-17-31-30(19)35-28(18)21/h1-17H
InChIKeyIHCUWMGIDTUIDV-UHFFFAOYSA-N
MW451.49 g/mol
LogP7.89
Rot. Bonds2

About 8-(1-dibenzofuran-1-ylbenzimidazol-2-yl)-[1]benzofuro[2,3-b]pyridine

8-(1-dibenzofuran-1-ylbenzimidazol-2-yl)-[1]benzofuro[2,3-b]pyridine (PubChem CID 156669158) has the molecular formula C30H17N3O2 and a molecular weight of 451.49 g/mol. Its IUPAC name is 8-(1-dibenzofuran-1-ylbenzimidazol-2-yl)-[1]benzofuro[2,3-b]pyridine.

Molecular Properties

Compound Name8-(1-dibenzofuran-1-ylbenzimidazol-2-yl)-[1]benzofuro[2,3-b]pyridine
PubChem CID156669158
Molecular FormulaC30H17N3O2
Molecular Weight451.49 g/mol
Exact Mass451.13
IUPAC Name8-(1-dibenzofuran-1-ylbenzimidazol-2-yl)-[1]benzofuro[2,3-b]pyridine
SMILESc1ccc2c(c1)nc(-c1cccc3c1oc1ncccc13)n2-c1cccc2oc3ccccc3c12
InChIInChI=1S/C30H17N3O2/c1-4-15-25-20(8-1)27-24(14-6-16-26(27)34-25)33-23-13-3-2-12-22(23)32-29(33)21-10-5-9-18-19-11-7-17-31-30(19)35-28(18)21/h1-17H
InChIKeyIHCUWMGIDTUIDV-UHFFFAOYSA-N
XLogP7.89
TPSA56.99 Ų
H-Bond Donors
H-Bond Acceptors5
Rotatable Bonds2
Heavy Atoms35
Complexity—

Lipinski Rule of Five

1 violation

RuleValue
MW ≤ 500451.49
LogP ≤ 57.89
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 105

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Related Compounds

8-(1-dibenzothiophen-4-ylbenzimidazol-2-yl)-[1]benzofuro[2,3-b]pyridine
CID 156667757
8-[1-(4-phenylphenyl)benzimidazol-2-yl]-[1]benzofuro[2,3-b]pyridine
CID 156671868
8-[1-(2,4,6-trimethylphenyl)benzimidazol-2-yl]-[1]benzofuro[2,3-b]pyridine
CID 156669778
[dideuterio-[2-(2-dibenzofuran-4-ylbenzimidazol-1-yl)phenyl]methyl]-trimethylsilane
CID 168730895
8-[1-[4-phenyl-2,6-di(propan-2-yl)phenyl]benzimidazol-2-yl]-[1]benzofuro[2,3-b]pyridine
CID 129021274
2-dibenzofuran-4-yl-1-(3-methylnaphthalen-2-yl)benzimidazole
CID 167339079
2-phenyl-8-[1-(2-phenylphenyl)benzimidazol-2-yl]-[1]benzofuro[2,3-b]pyridine
CID 156670352
2-dibenzofuran-4-yl-1-(9H-fluoren-1-yl)benzimidazole
CID 167355258
5-(9-dibenzofuran-1-ylcarbazol-3-yl)indolo[2,3-b][1,5]naphthyridine
CID 146328956
2-(9-fluorodibenzofuran-4-yl)-1-naphthalen-1-ylbenzimidazole
CID 156658241
2-(1-fluorodibenzofuran-4-yl)-1-(2-phenylphenyl)benzimidazole
CID 156659191
1-dibenzofuran-4-yl-2-[1-[4-(trideuteriomethyl)phenyl]dibenzofuran-4-yl]benzimidazole
CID 156657603

Frequently Asked Questions

What is the IUPAC name of 8-(1-dibenzofuran-1-ylbenzimidazol-2-yl)-[1]benzofuro[2,3-b]pyridine?
The IUPAC name of 8-(1-dibenzofuran-1-ylbenzimidazol-2-yl)-[1]benzofuro[2,3-b]pyridine (CID 156669158) is 8-(1-dibenzofuran-1-ylbenzimidazol-2-yl)-[1]benzofuro[2,3-b]pyridine.
What is the SMILES notation for 8-(1-dibenzofuran-1-ylbenzimidazol-2-yl)-[1]benzofuro[2,3-b]pyridine?
The canonical SMILES for 8-(1-dibenzofuran-1-ylbenzimidazol-2-yl)-[1]benzofuro[2,3-b]pyridine is c1ccc2c(c1)nc(-c1cccc3c1oc1ncccc13)n2-c1cccc2oc3ccccc3c12.
What is the InChIKey of 8-(1-dibenzofuran-1-ylbenzimidazol-2-yl)-[1]benzofuro[2,3-b]pyridine?
The InChIKey is IHCUWMGIDTUIDV-UHFFFAOYSA-N. The full InChI is InChI=1S/C30H17N3O2/c1-4-15-25-20(8-1)27-24(14-6-16-26(27)34-25)33-23-13-3-2-12-22(23)32-29(33)21-10-5-9-18-19-11-7-17-31-30(19)35-28(18)21/h1-17H.
What are the key properties of 8-(1-dibenzofuran-1-ylbenzimidazol-2-yl)-[1]benzofuro[2,3-b]pyridine?
8-(1-dibenzofuran-1-ylbenzimidazol-2-yl)-[1]benzofuro[2,3-b]pyridine has a molecular weight of 451.49 g/mol, XLogP of 7.89, 2 rotatable bonds, 0 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 8-(1-dibenzofuran-1-ylbenzimidazol-2-yl)-[1]benzofuro[2,3-b]pyridine is sourced from PubChem (CID 156669158), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).