2-[3-[3-dibenzofuran-2-yl-5-[3-(6-pyridin-3-yl-2-pyridinyl)phenyl]phenyl]phenyl]-6-pyridin-3-ylpyridine;2-[3-[3-dibenzofuran-2-yl-5-[3-(6-pyridin-4-yl-2-pyridinyl)phenyl]phenyl]phenyl]-6-pyridin-4-ylpyridine;5-[6-[3-[3-dibenzofuran-2-yl-5-[3-(3-pyrimidin-5-ylphenyl)phenyl]phenyl]phenyl]-2-pyridinyl]pyrimidine

C149H95N13O3 — CID 165060977

IUPAC2-[3-[3-dibenzofuran-2-yl-5-[3-(6-pyridin-3-yl-2-pyridinyl)phenyl]phenyl]phenyl]-6-pyridin-3-ylpyridine;2-[3-[3-dibenzofuran-2-yl-5-[3-(6-pyridin-4-yl-2-pyridinyl)phenyl]phenyl]phenyl]-6-pyridin-4-ylpyridine;5-[6-[3-[3-dibenzofuran-2-yl-5-[3-(3-pyrimidin-5-ylphenyl)phenyl]phenyl]phenyl]-2-pyridinyl]pyrimidine
SMILESc1cc(-c2cc(-c3cccc(-c4cccc(-c5ccncc5)n4)c3)cc(-c3ccc4oc5ccccc5c4c3)c2)cc(-c2cccc(-c3ccncc3)n2)c1.c1cc(-c2cncnc2)cc(-c2cccc(-c3cc(-c4cccc(-c5cccc(-c6cncnc6)n5)c4)cc(-c4ccc5oc6ccccc6c5c4)c3)c2)c1.c1cncc(-c2cccc(-c3cccc(-c4cc(-c5cccc(-c6cccc(-c7cccnc7)n6)c5)cc(-c5ccc6oc7ccccc7c6c5)c4)c3)n2)c1
InChIInChI=1S/2C50H32N4O.C49H31N5O/c1-2-20-49-43(15-1)44-30-35(21-22-50(44)55-49)42-28-40(33-9-3-11-36(25-33)45-16-5-18-47(53-45)38-13-7-23-51-31-38)27-41(29-42)34-10-4-12-37(26-34)46-17-6-19-48(54-46)39-14-8-24-52-32-39;1-2-16-49-43(11-1)44-32-37(17-18-50(44)55-49)42-30-40(35-7-3-9-38(27-35)47-14-5-12-45(53-47)33-19-23-51-24-20-33)29-41(31-42)36-8-4-10-39(28-36)48-15-6-13-46(54-48)34-21-25-52-26-22-34;1-2-16-48-44(13-1)45-25-37(17-18-49(45)55-48)41-23-39(34-9-3-7-32(19-34)33-8-4-11-36(20-33)42-26-50-30-51-27-42)22-40(24-41)35-10-5-12-38(21-35)46-14-6-15-47(54-46)43-28-52-31-53-29-43/h2*1-32H;1-31H
InChIKeyRERUOBITWLVVNB-UHFFFAOYSA-N
MW2115.49 g/mol
LogP37.90
Rot. Bonds21

About 2-[3-[3-dibenzofuran-2-yl-5-[3-(6-pyridin-3-yl-2-pyridinyl)phenyl]phenyl]phenyl]-6-pyridin-3-ylpyridine;2-[3-[3-dibenzofuran-2-yl-5-[3-(6-pyridin-4-yl-2-pyridinyl)phenyl]phenyl]phenyl]-6-pyridin-4-ylpyridine;5-[6-[3-[3-dibenzofuran-2-yl-5-[3-(3-pyrimidin-5-ylphenyl)phenyl]phenyl]phenyl]-2-pyridinyl]pyrimidine

2-[3-[3-dibenzofuran-2-yl-5-[3-(6-pyridin-3-yl-2-pyridinyl)phenyl]phenyl]phenyl]-6-pyridin-3-ylpyridine;2-[3-[3-dibenzofuran-2-yl-5-[3-(6-pyridin-4-yl-2-pyridinyl)phenyl]phenyl]phenyl]-6-pyridin-4-ylpyridine;5-[6-[3-[3-dibenzofuran-2-yl-5-[3-(3-pyrimidin-5-ylphenyl)phenyl]phenyl]phenyl]-2-pyridinyl]pyrimidine (PubChem CID 165060977) has the molecular formula C149H95N13O3 and a molecular weight of 2115.49 g/mol. Its IUPAC name is 2-[3-[3-dibenzofuran-2-yl-5-[3-(6-pyridin-3-yl-2-pyridinyl)phenyl]phenyl]phenyl]-6-pyridin-3-ylpyridine;2-[3-[3-dibenzofuran-2-yl-5-[3-(6-pyridin-4-yl-2-pyridinyl)phenyl]phenyl]phenyl]-6-pyridin-4-ylpyridine;5-[6-[3-[3-dibenzofuran-2-yl-5-[3-(3-pyrimidin-5-ylphenyl)phenyl]phenyl]phenyl]-2-pyridinyl]pyrimidine.

Molecular Properties

Compound Name2-[3-[3-dibenzofuran-2-yl-5-[3-(6-pyridin-3-yl-2-pyridinyl)phenyl]phenyl]phenyl]-6-pyridin-3-ylpyridine;2-[3-[3-dibenzofuran-2-yl-5-[3-(6-pyridin-4-yl-2-pyridinyl)phenyl]phenyl]phenyl]-6-pyridin-4-ylpyridine;5-[6-[3-[3-dibenzofuran-2-yl-5-[3-(3-pyrimidin-5-ylphenyl)phenyl]phenyl]phenyl]-2-pyridinyl]pyrimidine
PubChem CID165060977
Molecular FormulaC149H95N13O3
Molecular Weight2115.49 g/mol
Exact Mass2113.77
IUPAC Name2-[3-[3-dibenzofuran-2-yl-5-[3-(6-pyridin-3-yl-2-pyridinyl)phenyl]phenyl]phenyl]-6-pyridin-3-ylpyridine;2-[3-[3-dibenzofuran-2-yl-5-[3-(6-pyridin-4-yl-2-pyridinyl)phenyl]phenyl]phenyl]-6-pyridin-4-ylpyridine;5-[6-[3-[3-dibenzofuran-2-yl-5-[3-(3-pyrimidin-5-ylphenyl)phenyl]phenyl]phenyl]-2-pyridinyl]pyrimidine
SMILESc1cc(-c2cc(-c3cccc(-c4cccc(-c5ccncc5)n4)c3)cc(-c3ccc4oc5ccccc5c4c3)c2)cc(-c2cccc(-c3ccncc3)n2)c1.c1cc(-c2cncnc2)cc(-c2cccc(-c3cc(-c4cccc(-c5cccc(-c6cncnc6)n5)c4)cc(-c4ccc5oc6ccccc6c5c4)c3)c2)c1.c1cncc(-c2cccc(-c3cccc(-c4cc(-c5cccc(-c6cccc(-c7cccnc7)n6)c5)cc(-c5ccc6oc7ccccc7c6c5)c4)c3)n2)c1
InChIInChI=1S/2C50H32N4O.C49H31N5O/c1-2-20-49-43(15-1)44-30-35(21-22-50(44)55-49)42-28-40(33-9-3-11-36(25-33)45-16-5-18-47(53-45)38-13-7-23-51-31-38)27-41(29-42)34-10-4-12-37(26-34)46-17-6-19-48(54-46)39-14-8-24-52-32-39;1-2-16-49-43(11-1)44-32-37(17-18-50(44)55-49)42-30-40(35-7-3-9-38(27-35)47-14-5-12-45(53-47)33-19-23-51-24-20-33)29-41(31-42)36-8-4-10-39(28-36)48-15-6-13-46(54-48)34-21-25-52-26-22-34;1-2-16-48-44(13-1)45-25-37(17-18-49(45)55-48)41-23-39(34-9-3-7-32(19-34)33-8-4-11-36(20-33)42-26-50-30-51-27-42)22-40(24-41)35-10-5-12-38(21-35)46-14-6-15-47(54-46)43-28-52-31-53-29-43/h2*1-32H;1-31H
InChIKeyRERUOBITWLVVNB-UHFFFAOYSA-N
XLogP37.90
TPSA206.99 Ų
H-Bond Donors
H-Bond Acceptors16
Rotatable Bonds21
Heavy Atoms165
Complexity—

Lipinski Rule of Five

3 violations

RuleValue
MW ≤ 5002115.49
LogP ≤ 537.90
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 1016

Analyze 2-[3-[3-dibenzofuran-2-yl-5-[3-(6-pyridin-3-yl-2-pyridinyl)phenyl]phenyl]phenyl]-6-pyridin-3-ylpyridine;2-[3-[3-dibenzofuran-2-yl-5-[3-(6-pyridin-4-yl-2-pyridinyl)phenyl]phenyl]phenyl]-6-pyridin-4-ylpyridine;5-[6-[3-[3-dibenzofuran-2-yl-5-[3-(3-pyrimidin-5-ylphenyl)phenyl]phenyl]phenyl]-2-pyridinyl]pyrimidine with MolForge

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Related Compounds

4-[3-[3-[3-dibenzofuran-2-yl-5-[3-(3-pyridin-4-ylphenyl)phenyl]phenyl]phenyl]phenyl]pyridine
CID 155116790
2-[3,5-di(dibenzofuran-2-yl)phenyl]-4-phenyl-6-(3-pyridin-2-ylphenyl)-1,3,5-triazine;2-[3,5-di(dibenzofuran-2-yl)phenyl]-4-phenyl-6-(4-pyridin-3-ylphenyl)-1,3,5-triazine;2-[3,5-di(dibenzofuran-2-yl)phenyl]-4-phenyl-6-(4-pyridin-4-ylphenyl)-1,3,5-triazine;2-[3,5-di(dibenzofuran-2-yl)phenyl]-4-phenyl-6-(3-pyrimidin-2-ylphenyl)-1,3,5-triazine
CID 158843888
4-[3-dibenzofuran-2-yl-5-(3-phenylphenyl)phenyl]-2-phenyl-6-(3-pyridin-3-ylphenyl)pyrimidine
CID 171583697
6-[6-[6-[8-([1]benzofuro[2,3-c]pyridin-6-yl)dibenzofuran-2-yl]-2-pyridinyl]-2-pyridinyl]-[1]benzofuro[2,3-c]pyridine
CID 90250427
2-pyridin-3-yl-6-[3-[3-[3-(6-pyridin-3-yl-2-pyridinyl)phenyl]-5-triphenylen-2-ylphenyl]phenyl]pyridine
CID 164785689
4-[3-dibenzofuran-2-yl-5-(3-phenylphenyl)phenyl]-2-phenyl-6-(3-pyridin-4-ylphenyl)pyrimidine
CID 171582598
4-[3,5-di(dibenzofuran-2-yl)phenyl]-2-phenyl-6-(3-pyridin-4-ylphenyl)pyrimidine
CID 130262793
5-[6-[3-[3-[3-(6-pyrimidin-5-yl-2-pyridinyl)phenyl]-5-triphenylen-2-ylphenyl]phenyl]-2-pyridinyl]pyrimidine
CID 164785738
4-(4-dibenzofuran-2-ylphenyl)-6-(4-naphthalen-2-ylphenyl)-2-(3-pyridin-3-ylphenyl)pyrimidine
CID 130262931
4-dibenzofuran-2-yl-6-(3-dibenzofuran-2-yl-5-pyridin-4-ylphenyl)-2-phenylpyrimidine
CID 154949936
8-[3-[8-([1]benzofuro[3,2-b]pyridin-8-yl)dibenzofuran-2-yl]phenyl]-[1]benzofuro[3,2-c]pyridine;6-[6-[8-([1]benzofuro[3,2-b]pyridin-8-yl)dibenzofuran-2-yl]-2-pyridinyl]-[1]benzofuro[2,3-c]pyridine;8-[3-[8-([1]benzofuro[3,2-c]pyridin-8-yl)dibenzofuran-2-yl]phenyl]-[1]benzofuro[3,2-c]pyridine;8-[3-[3-[8-([1]benzofuro[3,2-c]pyridin-8-yl)dibenzofuran-2-yl]phenyl]phenyl]-[1]benzofuro[3,2-c]pyridine;8-[3-[3-[3-[8-([1]benzofuro[3,2-c]pyridin-8-yl)dibenzofuran-2-yl]phenyl]phenyl]phenyl]-[1]benzofuro[3,2-c]pyridine
CID 167677651
5-[6-[3-[3-phenanthren-3-yl-5-[3-(6-pyrimidin-5-yl-2-pyridinyl)phenyl]phenyl]phenyl]-2-pyridinyl]pyrimidine
CID 164785747

Frequently Asked Questions

What is the IUPAC name of 2-[3-[3-dibenzofuran-2-yl-5-[3-(6-pyridin-3-yl-2-pyridinyl)phenyl]phenyl]phenyl]-6-pyridin-3-ylpyridine;2-[3-[3-dibenzofuran-2-yl-5-[3-(6-pyridin-4-yl-2-pyridinyl)phenyl]phenyl]phenyl]-6-pyridin-4-ylpyridine;5-[6-[3-[3-dibenzofuran-2-yl-5-[3-(3-pyrimidin-5-ylphenyl)phenyl]phenyl]phenyl]-2-pyridinyl]pyrimidine?
The IUPAC name of 2-[3-[3-dibenzofuran-2-yl-5-[3-(6-pyridin-3-yl-2-pyridinyl)phenyl]phenyl]phenyl]-6-pyridin-3-ylpyridine;2-[3-[3-dibenzofuran-2-yl-5-[3-(6-pyridin-4-yl-2-pyridinyl)phenyl]phenyl]phenyl]-6-pyridin-4-ylpyridine;5-[6-[3-[3-dibenzofuran-2-yl-5-[3-(3-pyrimidin-5-ylphenyl)phenyl]phenyl]phenyl]-2-pyridinyl]pyrimidine (CID 165060977) is 2-[3-[3-dibenzofuran-2-yl-5-[3-(6-pyridin-3-yl-2-pyridinyl)phenyl]phenyl]phenyl]-6-pyridin-3-ylpyridine;2-[3-[3-dibenzofuran-2-yl-5-[3-(6-pyridin-4-yl-2-pyridinyl)phenyl]phenyl]phenyl]-6-pyridin-4-ylpyridine;5-[6-[3-[3-dibenzofuran-2-yl-5-[3-(3-pyrimidin-5-ylphenyl)phenyl]phenyl]phenyl]-2-pyridinyl]pyrimidine.
What is the SMILES notation for 2-[3-[3-dibenzofuran-2-yl-5-[3-(6-pyridin-3-yl-2-pyridinyl)phenyl]phenyl]phenyl]-6-pyridin-3-ylpyridine;2-[3-[3-dibenzofuran-2-yl-5-[3-(6-pyridin-4-yl-2-pyridinyl)phenyl]phenyl]phenyl]-6-pyridin-4-ylpyridine;5-[6-[3-[3-dibenzofuran-2-yl-5-[3-(3-pyrimidin-5-ylphenyl)phenyl]phenyl]phenyl]-2-pyridinyl]pyrimidine?
The canonical SMILES for 2-[3-[3-dibenzofuran-2-yl-5-[3-(6-pyridin-3-yl-2-pyridinyl)phenyl]phenyl]phenyl]-6-pyridin-3-ylpyridine;2-[3-[3-dibenzofuran-2-yl-5-[3-(6-pyridin-4-yl-2-pyridinyl)phenyl]phenyl]phenyl]-6-pyridin-4-ylpyridine;5-[6-[3-[3-dibenzofuran-2-yl-5-[3-(3-pyrimidin-5-ylphenyl)phenyl]phenyl]phenyl]-2-pyridinyl]pyrimidine is c1cc(-c2cc(-c3cccc(-c4cccc(-c5ccncc5)n4)c3)cc(-c3ccc4oc5ccccc5c4c3)c2)cc(-c2cccc(-c3ccncc3)n2)c1.c1cc(-c2cncnc2)cc(-c2cccc(-c3cc(-c4cccc(-c5cccc(-c6cncnc6)n5)c4)cc(-c4ccc5oc6ccccc6c5c4)c3)c2)c1.c1cncc(-c2cccc(-c3cccc(-c4cc(-c5cccc(-c6cccc(-c7cccnc7)n6)c5)cc(-c5ccc6oc7ccccc7c6c5)c4)c3)n2)c1.
What is the InChIKey of 2-[3-[3-dibenzofuran-2-yl-5-[3-(6-pyridin-3-yl-2-pyridinyl)phenyl]phenyl]phenyl]-6-pyridin-3-ylpyridine;2-[3-[3-dibenzofuran-2-yl-5-[3-(6-pyridin-4-yl-2-pyridinyl)phenyl]phenyl]phenyl]-6-pyridin-4-ylpyridine;5-[6-[3-[3-dibenzofuran-2-yl-5-[3-(3-pyrimidin-5-ylphenyl)phenyl]phenyl]phenyl]-2-pyridinyl]pyrimidine?
The InChIKey is RERUOBITWLVVNB-UHFFFAOYSA-N. The full InChI is InChI=1S/2C50H32N4O.C49H31N5O/c1-2-20-49-43(15-1)44-30-35(21-22-50(44)55-49)42-28-40(33-9-3-11-36(25-33)45-16-5-18-47(53-45)38-13-7-23-51-31-38)27-41(29-42)34-10-4-12-37(26-34)46-17-6-19-48(54-46)39-14-8-24-52-32-39;1-2-16-49-43(11-1)44-32-37(17-18-50(44)55-49)42-30-40(35-7-3-9-38(27-35)47-14-5-12-45(53-47)33-19-23-51-24-20-33)29-41(31-42)36-8-4-10-39(28-36)48-15-6-13-46(54-48)34-21-25-52-26-22-34;1-2-16-48-44(13-1)45-25-37(17-18-49(45)55-48)41-23-39(34-9-3-7-32(19-34)33-8-4-11-36(20-33)42-26-50-30-51-27-42)22-40(24-41)35-10-5-12-38(21-35)46-14-6-15-47(54-46)43-28-52-31-53-29-43/h2*1-32H;1-31H.
What are the key properties of 2-[3-[3-dibenzofuran-2-yl-5-[3-(6-pyridin-3-yl-2-pyridinyl)phenyl]phenyl]phenyl]-6-pyridin-3-ylpyridine;2-[3-[3-dibenzofuran-2-yl-5-[3-(6-pyridin-4-yl-2-pyridinyl)phenyl]phenyl]phenyl]-6-pyridin-4-ylpyridine;5-[6-[3-[3-dibenzofuran-2-yl-5-[3-(3-pyrimidin-5-ylphenyl)phenyl]phenyl]phenyl]-2-pyridinyl]pyrimidine?
2-[3-[3-dibenzofuran-2-yl-5-[3-(6-pyridin-3-yl-2-pyridinyl)phenyl]phenyl]phenyl]-6-pyridin-3-ylpyridine;2-[3-[3-dibenzofuran-2-yl-5-[3-(6-pyridin-4-yl-2-pyridinyl)phenyl]phenyl]phenyl]-6-pyridin-4-ylpyridine;5-[6-[3-[3-dibenzofuran-2-yl-5-[3-(3-pyrimidin-5-ylphenyl)phenyl]phenyl]phenyl]-2-pyridinyl]pyrimidine has a molecular weight of 2115.49 g/mol, XLogP of 37.90, 21 rotatable bonds, 0 hydrogen bond donors, and 16 hydrogen bond acceptors.
Where does this data come from?
All data for 2-[3-[3-dibenzofuran-2-yl-5-[3-(6-pyridin-3-yl-2-pyridinyl)phenyl]phenyl]phenyl]-6-pyridin-3-ylpyridine;2-[3-[3-dibenzofuran-2-yl-5-[3-(6-pyridin-4-yl-2-pyridinyl)phenyl]phenyl]phenyl]-6-pyridin-4-ylpyridine;5-[6-[3-[3-dibenzofuran-2-yl-5-[3-(3-pyrimidin-5-ylphenyl)phenyl]phenyl]phenyl]-2-pyridinyl]pyrimidine is sourced from PubChem (CID 165060977), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).