2-[6,8-bis(3-pyridin-4-ylphenyl)dibenzofuran-1-yl]-4,6-diphenyl-1,3,5-triazine;4-[4-(4-cyanophenyl)-9-(4,6-diphenyl-1,3,5-triazin-2-yl)dibenzofuran-2-yl]benzonitrile;4-[4-[4-[4-(4-cyanophenyl)phenyl]-9-(4,6-diphenyl-1,3,5-triazin-2-yl)dibenzofuran-2-yl]phenyl]benzonitrile

C143H85N15O3 — CID 160856208

IUPAC2-[6,8-bis(3-pyridin-4-ylphenyl)dibenzofuran-1-yl]-4,6-diphenyl-1,3,5-triazine;4-[4-(4-cyanophenyl)-9-(4,6-diphenyl-1,3,5-triazin-2-yl)dibenzofuran-2-yl]benzonitrile;4-[4-[4-[4-(4-cyanophenyl)phenyl]-9-(4,6-diphenyl-1,3,5-triazin-2-yl)dibenzofuran-2-yl]phenyl]benzonitrile
SMILESN#Cc1ccc(-c2cc(-c3ccc(C#N)cc3)c3oc4cccc(-c5nc(-c6ccccc6)nc(-c6ccccc6)n5)c4c3c2)cc1.N#Cc1ccc(-c2ccc(-c3cc(-c4ccc(-c5ccc(C#N)cc5)cc4)c4oc5cccc(-c6nc(-c7ccccc7)nc(-c7ccccc7)n6)c5c4c3)cc2)cc1.c1ccc(-c2nc(-c3ccccc3)nc(-c3cccc4oc5c(-c6cccc(-c7ccncc7)c6)cc(-c6cccc(-c7ccncc7)c6)cc5c34)n2)cc1
InChIInChI=1S/C53H31N5O.C49H31N5O.C41H23N5O/c54-32-34-14-18-36(19-15-34)38-22-24-40(25-23-38)44-30-46(41-28-26-39(27-29-41)37-20-16-35(33-55)17-21-37)50-47(31-44)49-45(12-7-13-48(49)59-50)53-57-51(42-8-3-1-4-9-42)56-52(58-53)43-10-5-2-6-11-43;1-3-10-34(11-4-1)47-52-48(35-12-5-2-6-13-35)54-49(53-47)41-18-9-19-44-45(41)43-31-40(38-16-7-14-36(28-38)32-20-24-50-25-21-32)30-42(46(43)55-44)39-17-8-15-37(29-39)33-22-26-51-27-23-33;42-24-26-14-18-28(19-15-26)32-22-34(29-20-16-27(25-43)17-21-29)38-35(23-32)37-33(12-7-13-36(37)47-38)41-45-39(30-8-3-1-4-9-30)44-40(46-41)31-10-5-2-6-11-31/h1-31H;1-31H;1-23H
InChIKeySJWWXRTUTRXJDB-UHFFFAOYSA-N
MW2061.35 g/mol
LogP35.26
Rot. Bonds19

About 2-[6,8-bis(3-pyridin-4-ylphenyl)dibenzofuran-1-yl]-4,6-diphenyl-1,3,5-triazine;4-[4-(4-cyanophenyl)-9-(4,6-diphenyl-1,3,5-triazin-2-yl)dibenzofuran-2-yl]benzonitrile;4-[4-[4-[4-(4-cyanophenyl)phenyl]-9-(4,6-diphenyl-1,3,5-triazin-2-yl)dibenzofuran-2-yl]phenyl]benzonitrile

2-[6,8-bis(3-pyridin-4-ylphenyl)dibenzofuran-1-yl]-4,6-diphenyl-1,3,5-triazine;4-[4-(4-cyanophenyl)-9-(4,6-diphenyl-1,3,5-triazin-2-yl)dibenzofuran-2-yl]benzonitrile;4-[4-[4-[4-(4-cyanophenyl)phenyl]-9-(4,6-diphenyl-1,3,5-triazin-2-yl)dibenzofuran-2-yl]phenyl]benzonitrile (PubChem CID 160856208) has the molecular formula C143H85N15O3 and a molecular weight of 2061.35 g/mol. Its IUPAC name is 2-[6,8-bis(3-pyridin-4-ylphenyl)dibenzofuran-1-yl]-4,6-diphenyl-1,3,5-triazine;4-[4-(4-cyanophenyl)-9-(4,6-diphenyl-1,3,5-triazin-2-yl)dibenzofuran-2-yl]benzonitrile;4-[4-[4-[4-(4-cyanophenyl)phenyl]-9-(4,6-diphenyl-1,3,5-triazin-2-yl)dibenzofuran-2-yl]phenyl]benzonitrile.

Molecular Properties

Compound Name2-[6,8-bis(3-pyridin-4-ylphenyl)dibenzofuran-1-yl]-4,6-diphenyl-1,3,5-triazine;4-[4-(4-cyanophenyl)-9-(4,6-diphenyl-1,3,5-triazin-2-yl)dibenzofuran-2-yl]benzonitrile;4-[4-[4-[4-(4-cyanophenyl)phenyl]-9-(4,6-diphenyl-1,3,5-triazin-2-yl)dibenzofuran-2-yl]phenyl]benzonitrile
PubChem CID160856208
Molecular FormulaC143H85N15O3
Molecular Weight2061.35 g/mol
Exact Mass2059.70
IUPAC Name2-[6,8-bis(3-pyridin-4-ylphenyl)dibenzofuran-1-yl]-4,6-diphenyl-1,3,5-triazine;4-[4-(4-cyanophenyl)-9-(4,6-diphenyl-1,3,5-triazin-2-yl)dibenzofuran-2-yl]benzonitrile;4-[4-[4-[4-(4-cyanophenyl)phenyl]-9-(4,6-diphenyl-1,3,5-triazin-2-yl)dibenzofuran-2-yl]phenyl]benzonitrile
SMILESN#Cc1ccc(-c2cc(-c3ccc(C#N)cc3)c3oc4cccc(-c5nc(-c6ccccc6)nc(-c6ccccc6)n5)c4c3c2)cc1.N#Cc1ccc(-c2ccc(-c3cc(-c4ccc(-c5ccc(C#N)cc5)cc4)c4oc5cccc(-c6nc(-c7ccccc7)nc(-c7ccccc7)n6)c5c4c3)cc2)cc1.c1ccc(-c2nc(-c3ccccc3)nc(-c3cccc4oc5c(-c6cccc(-c7ccncc7)c6)cc(-c6cccc(-c7ccncc7)c6)cc5c34)n2)cc1
InChIInChI=1S/C53H31N5O.C49H31N5O.C41H23N5O/c54-32-34-14-18-36(19-15-34)38-22-24-40(25-23-38)44-30-46(41-28-26-39(27-29-41)37-20-16-35(33-55)17-21-37)50-47(31-44)49-45(12-7-13-48(49)59-50)53-57-51(42-8-3-1-4-9-42)56-52(58-53)43-10-5-2-6-11-43;1-3-10-34(11-4-1)47-52-48(35-12-5-2-6-13-35)54-49(53-47)41-18-9-19-44-45(41)43-31-40(38-16-7-14-36(28-38)32-20-24-50-25-21-32)30-42(46(43)55-44)39-17-8-15-37(29-39)33-22-26-51-27-23-33;42-24-26-14-18-28(19-15-26)32-22-34(29-20-16-27(25-43)17-21-29)38-35(23-32)37-33(12-7-13-36(37)47-38)41-45-39(30-8-3-1-4-9-30)44-40(46-41)31-10-5-2-6-11-31/h1-31H;1-31H;1-23H
InChIKeySJWWXRTUTRXJDB-UHFFFAOYSA-N
XLogP35.26
TPSA276.37 Ų
H-Bond Donors
H-Bond Acceptors18
Rotatable Bonds19
Heavy Atoms161
Complexity—

Lipinski Rule of Five

3 violations

RuleValue
MW ≤ 5002061.35
LogP ≤ 535.26
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 1018

Analyze 2-[6,8-bis(3-pyridin-4-ylphenyl)dibenzofuran-1-yl]-4,6-diphenyl-1,3,5-triazine;4-[4-(4-cyanophenyl)-9-(4,6-diphenyl-1,3,5-triazin-2-yl)dibenzofuran-2-yl]benzonitrile;4-[4-[4-[4-(4-cyanophenyl)phenyl]-9-(4,6-diphenyl-1,3,5-triazin-2-yl)dibenzofuran-2-yl]phenyl]benzonitrile with MolForge

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Related Compounds

2-[6,8-bis(3-phenylphenyl)dibenzofuran-1-yl]-4,6-diphenyl-1,3,5-triazine
CID 137496708
2-(6,8-diphenyldibenzofuran-1-yl)-4-phenyl-6-(4-phenylphenyl)-1,3,5-triazine
CID 147117573
2-dibenzofuran-4-yl-4-methyl-6-(3-phenylphenyl)-1,3,5-triazine;2-dibenzofuran-4-yl-4-methyl-6-(4-phenylphenyl)-1,3,5-triazine;2-dibenzofuran-4-yl-4-methyl-6-phenyl-1,3,5-triazine;4-[4-methyl-6-(4-pyridin-4-ylphenyl)-1,3,5-triazin-2-yl]benzonitrile
CID 162023345
4-[2-(6,8-diphenyldibenzofuran-1-yl)-[1]benzofuro[3,2-d]pyrimidin-4-yl]benzonitrile
CID 153355176
2-(6,8-dinaphthalen-2-yldibenzofuran-1-yl)-4-phenyl-6-(4-phenylphenyl)-1,3,5-triazine
CID 137496577
2-dibenzofuran-1-yl-4-[3-[9-(4,6-diphenyl-1,3,5-triazin-2-yl)-4-phenyldibenzofuran-2-yl]phenyl]-6-phenyl-1,3,5-triazine
CID 166565423
2-[6,8-di(phenanthren-3-yl)dibenzofuran-1-yl]-4-phenyl-6-(4-phenylphenyl)-1,3,5-triazine
CID 137496724
4-[5-[4-[4-(4,6-diphenyl-1,3,5-triazin-2-yl)phenyl]phenyl]naphtho[1,2-b][1]benzofuran-7-yl]benzonitrile
CID 164835293
4-[5-[3-[4-(2,6-diphenylpyrimidin-4-yl)phenyl]phenyl]naphtho[1,2-b][1]benzofuran-7-yl]benzonitrile
CID 164834764
(4-cyanophenyl)boronic acid;4-[4-(4-cyanophenyl)-9-[3-(4,6-diphenyl-1,3,5-triazin-2-yl)phenyl]dibenzofuran-2-yl]benzonitrile;2-[3-(6,8-dichlorodibenzofuran-1-yl)phenyl]-4,6-diphenyl-1,3,5-triazine
CID 159097834
4-[4-[4-[9-(3-phenylphenyl)dibenzofuran-3-yl]-6-[4-(3-phenylphenyl)phenyl]-1,3,5-triazin-2-yl]phenyl]benzonitrile
CID 168774590
2-(4-phenylphenyl)-4-[6-(3-phenylphenyl)dibenzofuran-1-yl]-6-[4-(4-phenylphenyl)phenyl]-1,3,5-triazine
CID 164808572

Frequently Asked Questions

What is the IUPAC name of 2-[6,8-bis(3-pyridin-4-ylphenyl)dibenzofuran-1-yl]-4,6-diphenyl-1,3,5-triazine;4-[4-(4-cyanophenyl)-9-(4,6-diphenyl-1,3,5-triazin-2-yl)dibenzofuran-2-yl]benzonitrile;4-[4-[4-[4-(4-cyanophenyl)phenyl]-9-(4,6-diphenyl-1,3,5-triazin-2-yl)dibenzofuran-2-yl]phenyl]benzonitrile?
The IUPAC name of 2-[6,8-bis(3-pyridin-4-ylphenyl)dibenzofuran-1-yl]-4,6-diphenyl-1,3,5-triazine;4-[4-(4-cyanophenyl)-9-(4,6-diphenyl-1,3,5-triazin-2-yl)dibenzofuran-2-yl]benzonitrile;4-[4-[4-[4-(4-cyanophenyl)phenyl]-9-(4,6-diphenyl-1,3,5-triazin-2-yl)dibenzofuran-2-yl]phenyl]benzonitrile (CID 160856208) is 2-[6,8-bis(3-pyridin-4-ylphenyl)dibenzofuran-1-yl]-4,6-diphenyl-1,3,5-triazine;4-[4-(4-cyanophenyl)-9-(4,6-diphenyl-1,3,5-triazin-2-yl)dibenzofuran-2-yl]benzonitrile;4-[4-[4-[4-(4-cyanophenyl)phenyl]-9-(4,6-diphenyl-1,3,5-triazin-2-yl)dibenzofuran-2-yl]phenyl]benzonitrile.
What is the SMILES notation for 2-[6,8-bis(3-pyridin-4-ylphenyl)dibenzofuran-1-yl]-4,6-diphenyl-1,3,5-triazine;4-[4-(4-cyanophenyl)-9-(4,6-diphenyl-1,3,5-triazin-2-yl)dibenzofuran-2-yl]benzonitrile;4-[4-[4-[4-(4-cyanophenyl)phenyl]-9-(4,6-diphenyl-1,3,5-triazin-2-yl)dibenzofuran-2-yl]phenyl]benzonitrile?
The canonical SMILES for 2-[6,8-bis(3-pyridin-4-ylphenyl)dibenzofuran-1-yl]-4,6-diphenyl-1,3,5-triazine;4-[4-(4-cyanophenyl)-9-(4,6-diphenyl-1,3,5-triazin-2-yl)dibenzofuran-2-yl]benzonitrile;4-[4-[4-[4-(4-cyanophenyl)phenyl]-9-(4,6-diphenyl-1,3,5-triazin-2-yl)dibenzofuran-2-yl]phenyl]benzonitrile is N#Cc1ccc(-c2cc(-c3ccc(C#N)cc3)c3oc4cccc(-c5nc(-c6ccccc6)nc(-c6ccccc6)n5)c4c3c2)cc1.N#Cc1ccc(-c2ccc(-c3cc(-c4ccc(-c5ccc(C#N)cc5)cc4)c4oc5cccc(-c6nc(-c7ccccc7)nc(-c7ccccc7)n6)c5c4c3)cc2)cc1.c1ccc(-c2nc(-c3ccccc3)nc(-c3cccc4oc5c(-c6cccc(-c7ccncc7)c6)cc(-c6cccc(-c7ccncc7)c6)cc5c34)n2)cc1.
What is the InChIKey of 2-[6,8-bis(3-pyridin-4-ylphenyl)dibenzofuran-1-yl]-4,6-diphenyl-1,3,5-triazine;4-[4-(4-cyanophenyl)-9-(4,6-diphenyl-1,3,5-triazin-2-yl)dibenzofuran-2-yl]benzonitrile;4-[4-[4-[4-(4-cyanophenyl)phenyl]-9-(4,6-diphenyl-1,3,5-triazin-2-yl)dibenzofuran-2-yl]phenyl]benzonitrile?
The InChIKey is SJWWXRTUTRXJDB-UHFFFAOYSA-N. The full InChI is InChI=1S/C53H31N5O.C49H31N5O.C41H23N5O/c54-32-34-14-18-36(19-15-34)38-22-24-40(25-23-38)44-30-46(41-28-26-39(27-29-41)37-20-16-35(33-55)17-21-37)50-47(31-44)49-45(12-7-13-48(49)59-50)53-57-51(42-8-3-1-4-9-42)56-52(58-53)43-10-5-2-6-11-43;1-3-10-34(11-4-1)47-52-48(35-12-5-2-6-13-35)54-49(53-47)41-18-9-19-44-45(41)43-31-40(38-16-7-14-36(28-38)32-20-24-50-25-21-32)30-42(46(43)55-44)39-17-8-15-37(29-39)33-22-26-51-27-23-33;42-24-26-14-18-28(19-15-26)32-22-34(29-20-16-27(25-43)17-21-29)38-35(23-32)37-33(12-7-13-36(37)47-38)41-45-39(30-8-3-1-4-9-30)44-40(46-41)31-10-5-2-6-11-31/h1-31H;1-31H;1-23H.
What are the key properties of 2-[6,8-bis(3-pyridin-4-ylphenyl)dibenzofuran-1-yl]-4,6-diphenyl-1,3,5-triazine;4-[4-(4-cyanophenyl)-9-(4,6-diphenyl-1,3,5-triazin-2-yl)dibenzofuran-2-yl]benzonitrile;4-[4-[4-[4-(4-cyanophenyl)phenyl]-9-(4,6-diphenyl-1,3,5-triazin-2-yl)dibenzofuran-2-yl]phenyl]benzonitrile?
2-[6,8-bis(3-pyridin-4-ylphenyl)dibenzofuran-1-yl]-4,6-diphenyl-1,3,5-triazine;4-[4-(4-cyanophenyl)-9-(4,6-diphenyl-1,3,5-triazin-2-yl)dibenzofuran-2-yl]benzonitrile;4-[4-[4-[4-(4-cyanophenyl)phenyl]-9-(4,6-diphenyl-1,3,5-triazin-2-yl)dibenzofuran-2-yl]phenyl]benzonitrile has a molecular weight of 2061.35 g/mol, XLogP of 35.26, 19 rotatable bonds, 0 hydrogen bond donors, and 18 hydrogen bond acceptors.
Where does this data come from?
All data for 2-[6,8-bis(3-pyridin-4-ylphenyl)dibenzofuran-1-yl]-4,6-diphenyl-1,3,5-triazine;4-[4-(4-cyanophenyl)-9-(4,6-diphenyl-1,3,5-triazin-2-yl)dibenzofuran-2-yl]benzonitrile;4-[4-[4-[4-(4-cyanophenyl)phenyl]-9-(4,6-diphenyl-1,3,5-triazin-2-yl)dibenzofuran-2-yl]phenyl]benzonitrile is sourced from PubChem (CID 160856208), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).