2-[3-(2,8-diphenyldibenzofuran-4-yl)phenyl]pyridine

C35H23NO — CID 153423338

IUPAC2-[3-(2,8-diphenyldibenzofuran-4-yl)phenyl]pyridine
SMILESc1ccc(-c2ccc3oc4c(-c5cccc(-c6ccccn6)c5)cc(-c5ccccc5)cc4c3c2)cc1
InChIInChI=1S/C35H23NO/c1-3-10-24(11-4-1)26-17-18-34-31(21-26)32-23-29(25-12-5-2-6-13-25)22-30(35(32)37-34)27-14-9-15-28(20-27)33-16-7-8-19-36-33/h1-23H
InChIKeyWULGFWPWGCWZLL-UHFFFAOYSA-N
MW473.58 g/mol
LogP9.65
Rot. Bonds4

About 2-[3-(2,8-diphenyldibenzofuran-4-yl)phenyl]pyridine

2-[3-(2,8-diphenyldibenzofuran-4-yl)phenyl]pyridine (PubChem CID 153423338) has the molecular formula C35H23NO and a molecular weight of 473.58 g/mol. Its IUPAC name is 2-[3-(2,8-diphenyldibenzofuran-4-yl)phenyl]pyridine.

Molecular Properties

Compound Name2-[3-(2,8-diphenyldibenzofuran-4-yl)phenyl]pyridine
PubChem CID153423338
Molecular FormulaC35H23NO
Molecular Weight473.58 g/mol
Exact Mass473.18
IUPAC Name2-[3-(2,8-diphenyldibenzofuran-4-yl)phenyl]pyridine
SMILESc1ccc(-c2ccc3oc4c(-c5cccc(-c6ccccn6)c5)cc(-c5ccccc5)cc4c3c2)cc1
InChIInChI=1S/C35H23NO/c1-3-10-24(11-4-1)26-17-18-34-31(21-26)32-23-29(25-12-5-2-6-13-25)22-30(35(32)37-34)27-14-9-15-28(20-27)33-16-7-8-19-36-33/h1-23H
InChIKeyWULGFWPWGCWZLL-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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Related Compounds

Frequently Asked Questions

What is the IUPAC name of 2-[3-(2,8-diphenyldibenzofuran-4-yl)phenyl]pyridine?
The IUPAC name of 2-[3-(2,8-diphenyldibenzofuran-4-yl)phenyl]pyridine (CID 153423338) is 2-[3-(2,8-diphenyldibenzofuran-4-yl)phenyl]pyridine.
What is the SMILES notation for 2-[3-(2,8-diphenyldibenzofuran-4-yl)phenyl]pyridine?
The canonical SMILES for 2-[3-(2,8-diphenyldibenzofuran-4-yl)phenyl]pyridine is c1ccc(-c2ccc3oc4c(-c5cccc(-c6ccccn6)c5)cc(-c5ccccc5)cc4c3c2)cc1.
What is the InChIKey of 2-[3-(2,8-diphenyldibenzofuran-4-yl)phenyl]pyridine?
The InChIKey is WULGFWPWGCWZLL-UHFFFAOYSA-N. The full InChI is InChI=1S/C35H23NO/c1-3-10-24(11-4-1)26-17-18-34-31(21-26)32-23-29(25-12-5-2-6-13-25)22-30(35(32)37-34)27-14-9-15-28(20-27)33-16-7-8-19-36-33/h1-23H.
What are the key properties of 2-[3-(2,8-diphenyldibenzofuran-4-yl)phenyl]pyridine?
2-[3-(2,8-diphenyldibenzofuran-4-yl)phenyl]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-[3-(2,8-diphenyldibenzofuran-4-yl)phenyl]pyridine is sourced from PubChem (CID 153423338), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).