9-(2-dibenzofuran-4-ylphenyl)-3-[4-(4,6-diphenyl-2-pyridinyl)phenyl]carbazole

C53H34N2O — CID 118149283

IUPAC9-(2-dibenzofuran-4-ylphenyl)-3-[4-(4,6-diphenyl-2-pyridinyl)phenyl]carbazole
SMILESc1ccc(-c2cc(-c3ccccc3)nc(-c3ccc(-c4ccc5c(c4)c4ccccc4n5-c4ccccc4-c4cccc5c4oc4ccccc45)cc3)c2)cc1
InChIInChI=1S/C53H34N2O/c1-3-14-35(15-4-1)40-33-47(37-16-5-2-6-17-37)54-48(34-40)38-28-26-36(27-29-38)39-30-31-51-46(32-39)42-19-8-11-24-50(42)55(51)49-23-10-7-18-41(49)44-21-13-22-45-43-20-9-12-25-52(43)56-53(44)45/h1-34H
InChIKeyLZRJYWUIZYCGFC-UHFFFAOYSA-N
MW714.87 g/mol
LogP14.41
Rot. Bonds6

About 9-(2-dibenzofuran-4-ylphenyl)-3-[4-(4,6-diphenyl-2-pyridinyl)phenyl]carbazole

9-(2-dibenzofuran-4-ylphenyl)-3-[4-(4,6-diphenyl-2-pyridinyl)phenyl]carbazole (PubChem CID 118149283) has the molecular formula C53H34N2O and a molecular weight of 714.87 g/mol. Its IUPAC name is 9-(2-dibenzofuran-4-ylphenyl)-3-[4-(4,6-diphenyl-2-pyridinyl)phenyl]carbazole.

Molecular Properties

Compound Name9-(2-dibenzofuran-4-ylphenyl)-3-[4-(4,6-diphenyl-2-pyridinyl)phenyl]carbazole
PubChem CID118149283
Molecular FormulaC53H34N2O
Molecular Weight714.87 g/mol
Exact Mass714.27
IUPAC Name9-(2-dibenzofuran-4-ylphenyl)-3-[4-(4,6-diphenyl-2-pyridinyl)phenyl]carbazole
SMILESc1ccc(-c2cc(-c3ccccc3)nc(-c3ccc(-c4ccc5c(c4)c4ccccc4n5-c4ccccc4-c4cccc5c4oc4ccccc45)cc3)c2)cc1
InChIInChI=1S/C53H34N2O/c1-3-14-35(15-4-1)40-33-47(37-16-5-2-6-17-37)54-48(34-40)38-28-26-36(27-29-38)39-30-31-51-46(32-39)42-19-8-11-24-50(42)55(51)49-23-10-7-18-41(49)44-21-13-22-45-43-20-9-12-25-52(43)56-53(44)45/h1-34H
InChIKeyLZRJYWUIZYCGFC-UHFFFAOYSA-N
XLogP14.41
TPSA30.96 Ų
H-Bond Donors
H-Bond Acceptors3
Rotatable Bonds6
Heavy Atoms56
Complexity—

Lipinski Rule of Five

2 violations

RuleValue
MW ≤ 500714.87
LogP ≤ 514.41
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 103

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Related Compounds

9-(2-dibenzofuran-4-ylphenyl)-3-[3-(2,6-diphenyl-4-pyridinyl)phenyl]carbazole;9-(2-dibenzofuran-4-ylphenyl)-3-[2-(2,6-diphenylpyrimidin-4-yl)phenyl]carbazole;9-(2-dibenzofuran-4-ylphenyl)-3-[2-(4,6-diphenylpyrimidin-2-yl)phenyl]carbazole;9-(2-dibenzofuran-4-ylphenyl)-3-[2-(4,6-diphenyl-1,3,5-triazin-2-yl)phenyl]carbazole
CID 158166248
3-dibenzofuran-4-yl-9-(2-dibenzofuran-4-ylphenyl)-6-(9-phenylcarbazol-3-yl)carbazole
CID 177209647
3-(5-dibenzofuran-2-ylnaphthalen-1-yl)-9-[4-(4,6-diphenyl-2-pyridinyl)phenyl]carbazole;3-(5-dibenzofuran-4-ylnaphthalen-1-yl)-9-[4-(4,6-diphenyl-2-pyridinyl)phenyl]carbazole;3-(5-dibenzofuran-2-ylnaphthalen-1-yl)-9-[4-(4,6-diphenylpyrimidin-2-yl)phenyl]carbazole
CID 159689631
3-[3-(4,6-diphenyl-2-pyridinyl)phenyl]-9-(2,3,5,6-tetradeuterio-4-dibenzofuran-4-ylphenyl)carbazole
CID 118149555
2-dibenzofuran-2-yl-6-[3-(4,6-diphenyl-2-pyridinyl)carbazol-9-yl]benzonitrile
CID 122576028
9-(6-dibenzofuran-4-yldibenzofuran-2-yl)-3-phenylcarbazole
CID 146532981
2-dibenzofuran-4-yl-9-(4,6-diphenyl-2-pyridinyl)-6-(9-phenylcarbazol-2-yl)carbazole
CID 118508812
5-[4-(2-dibenzofuran-4-yl-6-phenyl-4-pyridinyl)phenyl]-[1]benzofuro[3,2-c]carbazole
CID 118154439
9-(4-dibenzofuran-4-ylphenyl)-3-[9-(4-dibenzofuran-3-yl-6-phenyl-2-pyridinyl)dibenzofuran-2-yl]carbazole
CID 168768588
5-[2-[2-([1]benzofuro[3,2-c]carbazol-5-yl)-5-(2,6-diphenylpyrimidin-4-yl)phenyl]phenyl]-[1]benzofuro[3,2-c]carbazole
CID 155463130
3-(4-dibenzofuran-4-yl-6-phenyl-1,3,5-triazin-2-yl)-9-(7-phenyldibenzofuran-4-yl)carbazole
CID 170080874
3-dibenzofuran-4-yl-9-(2,6-diphenylpyrimidin-4-yl)carbazole
CID 122451711

Frequently Asked Questions

What is the IUPAC name of 9-(2-dibenzofuran-4-ylphenyl)-3-[4-(4,6-diphenyl-2-pyridinyl)phenyl]carbazole?
The IUPAC name of 9-(2-dibenzofuran-4-ylphenyl)-3-[4-(4,6-diphenyl-2-pyridinyl)phenyl]carbazole (CID 118149283) is 9-(2-dibenzofuran-4-ylphenyl)-3-[4-(4,6-diphenyl-2-pyridinyl)phenyl]carbazole.
What is the SMILES notation for 9-(2-dibenzofuran-4-ylphenyl)-3-[4-(4,6-diphenyl-2-pyridinyl)phenyl]carbazole?
The canonical SMILES for 9-(2-dibenzofuran-4-ylphenyl)-3-[4-(4,6-diphenyl-2-pyridinyl)phenyl]carbazole is c1ccc(-c2cc(-c3ccccc3)nc(-c3ccc(-c4ccc5c(c4)c4ccccc4n5-c4ccccc4-c4cccc5c4oc4ccccc45)cc3)c2)cc1.
What is the InChIKey of 9-(2-dibenzofuran-4-ylphenyl)-3-[4-(4,6-diphenyl-2-pyridinyl)phenyl]carbazole?
The InChIKey is LZRJYWUIZYCGFC-UHFFFAOYSA-N. The full InChI is InChI=1S/C53H34N2O/c1-3-14-35(15-4-1)40-33-47(37-16-5-2-6-17-37)54-48(34-40)38-28-26-36(27-29-38)39-30-31-51-46(32-39)42-19-8-11-24-50(42)55(51)49-23-10-7-18-41(49)44-21-13-22-45-43-20-9-12-25-52(43)56-53(44)45/h1-34H.
What are the key properties of 9-(2-dibenzofuran-4-ylphenyl)-3-[4-(4,6-diphenyl-2-pyridinyl)phenyl]carbazole?
9-(2-dibenzofuran-4-ylphenyl)-3-[4-(4,6-diphenyl-2-pyridinyl)phenyl]carbazole has a molecular weight of 714.87 g/mol, XLogP of 14.41, 6 rotatable bonds, 0 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 9-(2-dibenzofuran-4-ylphenyl)-3-[4-(4,6-diphenyl-2-pyridinyl)phenyl]carbazole is sourced from PubChem (CID 118149283), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).