2-phenyl-6-[6-(4-phenylphenyl)dibenzofuran-4-yl]pyridine

C35H23NO — CID 171761185

IUPAC2-phenyl-6-[6-(4-phenylphenyl)dibenzofuran-4-yl]pyridine
SMILESc1ccc(-c2ccc(-c3cccc4c3oc3c(-c5cccc(-c6ccccc6)n5)cccc34)cc2)cc1
InChIInChI=1S/C35H23NO/c1-3-10-24(11-4-1)25-20-22-26(23-21-25)28-14-7-15-29-30-16-8-17-31(35(30)37-34(28)29)33-19-9-18-32(36-33)27-12-5-2-6-13-27/h1-23H
InChIKeyZGGDAHQNTJSMJS-UHFFFAOYSA-N
MW473.58 g/mol
LogP9.65
Rot. Bonds4

About 2-phenyl-6-[6-(4-phenylphenyl)dibenzofuran-4-yl]pyridine

2-phenyl-6-[6-(4-phenylphenyl)dibenzofuran-4-yl]pyridine (PubChem CID 171761185) has the molecular formula C35H23NO and a molecular weight of 473.58 g/mol. Its IUPAC name is 2-phenyl-6-[6-(4-phenylphenyl)dibenzofuran-4-yl]pyridine.

Molecular Properties

Compound Name2-phenyl-6-[6-(4-phenylphenyl)dibenzofuran-4-yl]pyridine
PubChem CID171761185
Molecular FormulaC35H23NO
Molecular Weight473.58 g/mol
Exact Mass473.18
IUPAC Name2-phenyl-6-[6-(4-phenylphenyl)dibenzofuran-4-yl]pyridine
SMILESc1ccc(-c2ccc(-c3cccc4c3oc3c(-c5cccc(-c6ccccc6)n5)cccc34)cc2)cc1
InChIInChI=1S/C35H23NO/c1-3-10-24(11-4-1)25-20-22-26(23-21-25)28-14-7-15-29-30-16-8-17-31(35(30)37-34(28)29)33-19-9-18-32(36-33)27-12-5-2-6-13-27/h1-23H
InChIKeyZGGDAHQNTJSMJS-UHFFFAOYSA-N
XLogP9.65
TPSA26.03 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds4
Heavy Atoms37
Complexity

Lipinski Rule of Five

1 violation

RuleValue
MW ≤ 500473.58
LogP ≤ 59.65
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 102

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Frequently Asked Questions

What is the IUPAC name of 2-phenyl-6-[6-(4-phenylphenyl)dibenzofuran-4-yl]pyridine?
The IUPAC name of 2-phenyl-6-[6-(4-phenylphenyl)dibenzofuran-4-yl]pyridine (CID 171761185) is 2-phenyl-6-[6-(4-phenylphenyl)dibenzofuran-4-yl]pyridine.
What is the SMILES notation for 2-phenyl-6-[6-(4-phenylphenyl)dibenzofuran-4-yl]pyridine?
The canonical SMILES for 2-phenyl-6-[6-(4-phenylphenyl)dibenzofuran-4-yl]pyridine is c1ccc(-c2ccc(-c3cccc4c3oc3c(-c5cccc(-c6ccccc6)n5)cccc34)cc2)cc1.
What is the InChIKey of 2-phenyl-6-[6-(4-phenylphenyl)dibenzofuran-4-yl]pyridine?
The InChIKey is ZGGDAHQNTJSMJS-UHFFFAOYSA-N. The full InChI is InChI=1S/C35H23NO/c1-3-10-24(11-4-1)25-20-22-26(23-21-25)28-14-7-15-29-30-16-8-17-31(35(30)37-34(28)29)33-19-9-18-32(36-33)27-12-5-2-6-13-27/h1-23H.
What are the key properties of 2-phenyl-6-[6-(4-phenylphenyl)dibenzofuran-4-yl]pyridine?
2-phenyl-6-[6-(4-phenylphenyl)dibenzofuran-4-yl]pyridine has a molecular weight of 473.58 g/mol, XLogP of 9.65, 4 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 2-phenyl-6-[6-(4-phenylphenyl)dibenzofuran-4-yl]pyridine is sourced from PubChem (CID 171761185), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).