2-(2-phenyl-6-pyridin-2-ylbenzimidazol-1-yl)-6-pyridin-2-ylphenol

C29H20N4O — CID 140889802

IUPAC2-(2-phenyl-6-pyridin-2-ylbenzimidazol-1-yl)-6-pyridin-2-ylphenol
SMILESOc1c(-c2ccccn2)cccc1-n1c(-c2ccccc2)nc2ccc(-c3ccccn3)cc21
InChIInChI=1S/C29H20N4O/c34-28-22(24-13-5-7-18-31-24)11-8-14-26(28)33-27-19-21(23-12-4-6-17-30-23)15-16-25(27)32-29(33)20-9-2-1-3-10-20/h1-19,34H
InChIKeyGCOADHDHZWIFLS-UHFFFAOYSA-N
MW440.51 g/mol
LogP6.52
Rot. Bonds4

About 2-(2-phenyl-6-pyridin-2-ylbenzimidazol-1-yl)-6-pyridin-2-ylphenol

2-(2-phenyl-6-pyridin-2-ylbenzimidazol-1-yl)-6-pyridin-2-ylphenol (PubChem CID 140889802) has the molecular formula C29H20N4O and a molecular weight of 440.51 g/mol. Its IUPAC name is 2-(2-phenyl-6-pyridin-2-ylbenzimidazol-1-yl)-6-pyridin-2-ylphenol.

Molecular Properties

Compound Name2-(2-phenyl-6-pyridin-2-ylbenzimidazol-1-yl)-6-pyridin-2-ylphenol
PubChem CID140889802
Molecular FormulaC29H20N4O
Molecular Weight440.51 g/mol
Exact Mass440.16
IUPAC Name2-(2-phenyl-6-pyridin-2-ylbenzimidazol-1-yl)-6-pyridin-2-ylphenol
SMILESOc1c(-c2ccccn2)cccc1-n1c(-c2ccccc2)nc2ccc(-c3ccccn3)cc21
InChIInChI=1S/C29H20N4O/c34-28-22(24-13-5-7-18-31-24)11-8-14-26(28)33-27-19-21(23-12-4-6-17-30-23)15-16-25(27)32-29(33)20-9-2-1-3-10-20/h1-19,34H
InChIKeyGCOADHDHZWIFLS-UHFFFAOYSA-N
XLogP6.52
TPSA63.83 Ų
H-Bond Donors1
H-Bond Acceptors5
Rotatable Bonds4
Heavy Atoms34
Complexity—

Lipinski Rule of Five

1 violation

RuleValue
MW ≤ 500440.51
LogP ≤ 56.52
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 105

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Related Compounds

2-(1-methyl-6-pyridin-2-ylbenzimidazol-2-yl)-9-(3-pyridin-2-ylphenyl)carbazole
CID 153285337
2-(1-methyl-6-pyridin-2-ylbenzimidazol-2-yl)-6-pyridin-2-yl-9-(3-pyridin-2-ylphenyl)carbazole
CID 153285580
2-[4-[2-[3-[2-[6-[5-[2-[3,5-bis[2-(4-pyridin-2-ylphenyl)phenyl]phenyl]phenyl]-2-pyridinyl]-3-pyridinyl]phenyl]-5-[2-[4-(1-phenylbenzimidazol-2-yl)phenyl]phenyl]phenyl]phenyl]phenyl]-1-phenylbenzimidazole
CID 153448985
2-benzyl-6-[6-(3-pyridin-2-ylphenyl)-2-pyridinyl]phenol
CID 164742350
2,4-ditert-butyl-6-[6-phenyl-1-(2-phenylphenyl)benzimidazol-2-yl]phenol
CID 176593542
2-[3-(2-phenylphenyl)phenyl]pyridine
CID 59403973
9-[4,6-bis(4-pyridin-2-ylphenyl)pyrimidin-2-yl]-2-[1-(2-methylphenyl)benzimidazol-2-yl]carbazole
CID 144705601
2-[3-[4-[4-[3-[3-[3-[3-(3-phenylphenyl)phenyl]phenyl]phenyl]phenyl]phenyl]phenyl]phenyl]pyridine
CID 171461302
4-(2,7-dipyridin-2-ylcarbazol-9-yl)-2-(4-phenylphenyl)isoindole-1,3-dione
CID 142280587
9-phenyl-2-pyridin-2-yl-6-[3-[2-(3-pyridin-2-ylphenyl)phenyl]phenyl]carbazole
CID 140814524
4-(2,7-dipyridin-2-ylcarbazol-9-yl)-2-phenylisoindole-1,3-dione
CID 158393455
9-[2,6-bis(4,6-diphenyl-1,3,5-triazin-2-yl)phenyl]-3,6-dipyridin-2-ylcarbazole
CID 167168656

Frequently Asked Questions

What is the IUPAC name of 2-(2-phenyl-6-pyridin-2-ylbenzimidazol-1-yl)-6-pyridin-2-ylphenol?
The IUPAC name of 2-(2-phenyl-6-pyridin-2-ylbenzimidazol-1-yl)-6-pyridin-2-ylphenol (CID 140889802) is 2-(2-phenyl-6-pyridin-2-ylbenzimidazol-1-yl)-6-pyridin-2-ylphenol.
What is the SMILES notation for 2-(2-phenyl-6-pyridin-2-ylbenzimidazol-1-yl)-6-pyridin-2-ylphenol?
The canonical SMILES for 2-(2-phenyl-6-pyridin-2-ylbenzimidazol-1-yl)-6-pyridin-2-ylphenol is Oc1c(-c2ccccn2)cccc1-n1c(-c2ccccc2)nc2ccc(-c3ccccn3)cc21.
What is the InChIKey of 2-(2-phenyl-6-pyridin-2-ylbenzimidazol-1-yl)-6-pyridin-2-ylphenol?
The InChIKey is GCOADHDHZWIFLS-UHFFFAOYSA-N. The full InChI is InChI=1S/C29H20N4O/c34-28-22(24-13-5-7-18-31-24)11-8-14-26(28)33-27-19-21(23-12-4-6-17-30-23)15-16-25(27)32-29(33)20-9-2-1-3-10-20/h1-19,34H.
What are the key properties of 2-(2-phenyl-6-pyridin-2-ylbenzimidazol-1-yl)-6-pyridin-2-ylphenol?
2-(2-phenyl-6-pyridin-2-ylbenzimidazol-1-yl)-6-pyridin-2-ylphenol has a molecular weight of 440.51 g/mol, XLogP of 6.52, 4 rotatable bonds, 1 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(2-phenyl-6-pyridin-2-ylbenzimidazol-1-yl)-6-pyridin-2-ylphenol is sourced from PubChem (CID 140889802), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).