4-dibenzofuran-4-yl-2-phenyl-6-[3-(9-phenylxanthen-9-yl)phenyl]pyrimidine;2-naphthalen-2-yl-4-phenyl-6-[3-(9-phenylxanthen-9-yl)phenyl]pyrimidine;4-naphthalen-1-yl-2-phenyl-6-[3-(9-phenylxanthen-9-yl)phenyl]pyrimidine;4-phenyl-2-(2-phenylphenyl)-6-[3-(9-phenylxanthen-9-yl)phenyl]pyrimidine

C184H122N8O5 — CID 158550405

IUPAC4-dibenzofuran-4-yl-2-phenyl-6-[3-(9-phenylxanthen-9-yl)phenyl]pyrimidine;2-naphthalen-2-yl-4-phenyl-6-[3-(9-phenylxanthen-9-yl)phenyl]pyrimidine;4-naphthalen-1-yl-2-phenyl-6-[3-(9-phenylxanthen-9-yl)phenyl]pyrimidine;4-phenyl-2-(2-phenylphenyl)-6-[3-(9-phenylxanthen-9-yl)phenyl]pyrimidine
SMILESc1ccc(-c2cc(-c3cccc(C4(c5ccccc5)c5ccccc5Oc5ccccc54)c3)nc(-c3ccc4ccccc4c3)n2)cc1.c1ccc(-c2cc(-c3cccc(C4(c5ccccc5)c5ccccc5Oc5ccccc54)c3)nc(-c3ccccc3-c3ccccc3)n2)cc1.c1ccc(-c2nc(-c3cccc(C4(c5ccccc5)c5ccccc5Oc5ccccc54)c3)cc(-c3cccc4c3oc3ccccc34)n2)cc1.c1ccc(-c2nc(-c3cccc(C4(c5ccccc5)c5ccccc5Oc5ccccc54)c3)cc(-c3cccc4ccccc34)n2)cc1
InChIInChI=1S/C47H30N2O2.C47H32N2O.2C45H30N2O/c1-3-15-31(16-4-1)46-48-40(30-41(49-46)37-23-14-22-36-35-21-7-10-26-42(35)51-45(36)37)32-17-13-20-34(29-32)47(33-18-5-2-6-19-33)38-24-8-11-27-43(38)50-44-28-12-9-25-39(44)47;1-4-17-33(18-5-1)38-25-10-11-26-39(38)46-48-42(34-19-6-2-7-20-34)32-43(49-46)35-21-16-24-37(31-35)47(36-22-8-3-9-23-36)40-27-12-14-29-44(40)50-45-30-15-13-28-41(45)47;1-3-16-32(17-4-1)44-46-40(30-41(47-44)37-24-14-18-31-15-7-8-23-36(31)37)33-19-13-22-35(29-33)45(34-20-5-2-6-21-34)38-25-9-11-27-42(38)48-43-28-12-10-26-39(43)45;1-3-15-32(16-4-1)40-30-41(47-44(46-40)35-27-26-31-14-7-8-17-33(31)28-35)34-18-13-21-37(29-34)45(36-19-5-2-6-20-36)38-22-9-11-24-42(38)48-43-25-12-10-23-39(43)45/h1-30H;1-32H;2*1-30H
InChIKeyHPQKPQJSDCKZFL-UHFFFAOYSA-N
MW2525.05 g/mol
LogP45.74
Rot. Bonds21

About 4-dibenzofuran-4-yl-2-phenyl-6-[3-(9-phenylxanthen-9-yl)phenyl]pyrimidine;2-naphthalen-2-yl-4-phenyl-6-[3-(9-phenylxanthen-9-yl)phenyl]pyrimidine;4-naphthalen-1-yl-2-phenyl-6-[3-(9-phenylxanthen-9-yl)phenyl]pyrimidine;4-phenyl-2-(2-phenylphenyl)-6-[3-(9-phenylxanthen-9-yl)phenyl]pyrimidine

4-dibenzofuran-4-yl-2-phenyl-6-[3-(9-phenylxanthen-9-yl)phenyl]pyrimidine;2-naphthalen-2-yl-4-phenyl-6-[3-(9-phenylxanthen-9-yl)phenyl]pyrimidine;4-naphthalen-1-yl-2-phenyl-6-[3-(9-phenylxanthen-9-yl)phenyl]pyrimidine;4-phenyl-2-(2-phenylphenyl)-6-[3-(9-phenylxanthen-9-yl)phenyl]pyrimidine (PubChem CID 158550405) has the molecular formula C184H122N8O5 and a molecular weight of 2525.05 g/mol. Its IUPAC name is 4-dibenzofuran-4-yl-2-phenyl-6-[3-(9-phenylxanthen-9-yl)phenyl]pyrimidine;2-naphthalen-2-yl-4-phenyl-6-[3-(9-phenylxanthen-9-yl)phenyl]pyrimidine;4-naphthalen-1-yl-2-phenyl-6-[3-(9-phenylxanthen-9-yl)phenyl]pyrimidine;4-phenyl-2-(2-phenylphenyl)-6-[3-(9-phenylxanthen-9-yl)phenyl]pyrimidine.

Molecular Properties

Compound Name4-dibenzofuran-4-yl-2-phenyl-6-[3-(9-phenylxanthen-9-yl)phenyl]pyrimidine;2-naphthalen-2-yl-4-phenyl-6-[3-(9-phenylxanthen-9-yl)phenyl]pyrimidine;4-naphthalen-1-yl-2-phenyl-6-[3-(9-phenylxanthen-9-yl)phenyl]pyrimidine;4-phenyl-2-(2-phenylphenyl)-6-[3-(9-phenylxanthen-9-yl)phenyl]pyrimidine
PubChem CID158550405
Molecular FormulaC184H122N8O5
Molecular Weight2525.05 g/mol
Exact Mass2522.95
IUPAC Name4-dibenzofuran-4-yl-2-phenyl-6-[3-(9-phenylxanthen-9-yl)phenyl]pyrimidine;2-naphthalen-2-yl-4-phenyl-6-[3-(9-phenylxanthen-9-yl)phenyl]pyrimidine;4-naphthalen-1-yl-2-phenyl-6-[3-(9-phenylxanthen-9-yl)phenyl]pyrimidine;4-phenyl-2-(2-phenylphenyl)-6-[3-(9-phenylxanthen-9-yl)phenyl]pyrimidine
SMILESc1ccc(-c2cc(-c3cccc(C4(c5ccccc5)c5ccccc5Oc5ccccc54)c3)nc(-c3ccc4ccccc4c3)n2)cc1.c1ccc(-c2cc(-c3cccc(C4(c5ccccc5)c5ccccc5Oc5ccccc54)c3)nc(-c3ccccc3-c3ccccc3)n2)cc1.c1ccc(-c2nc(-c3cccc(C4(c5ccccc5)c5ccccc5Oc5ccccc54)c3)cc(-c3cccc4c3oc3ccccc34)n2)cc1.c1ccc(-c2nc(-c3cccc(C4(c5ccccc5)c5ccccc5Oc5ccccc54)c3)cc(-c3cccc4ccccc34)n2)cc1
InChIInChI=1S/C47H30N2O2.C47H32N2O.2C45H30N2O/c1-3-15-31(16-4-1)46-48-40(30-41(49-46)37-23-14-22-36-35-21-7-10-26-42(35)51-45(36)37)32-17-13-20-34(29-32)47(33-18-5-2-6-19-33)38-24-8-11-27-43(38)50-44-28-12-9-25-39(44)47;1-4-17-33(18-5-1)38-25-10-11-26-39(38)46-48-42(34-19-6-2-7-20-34)32-43(49-46)35-21-16-24-37(31-35)47(36-22-8-3-9-23-36)40-27-12-14-29-44(40)50-45-30-15-13-28-41(45)47;1-3-16-32(17-4-1)44-46-40(30-41(47-44)37-24-14-18-31-15-7-8-23-36(31)37)33-19-13-22-35(29-33)45(34-20-5-2-6-21-34)38-25-9-11-27-42(38)48-43-28-12-10-26-39(43)45;1-3-15-32(16-4-1)40-30-41(47-44(46-40)35-27-26-31-14-7-8-17-33(31)28-35)34-18-13-21-37(29-34)45(36-19-5-2-6-20-36)38-22-9-11-24-42(38)48-43-25-12-10-23-39(43)45/h1-30H;1-32H;2*1-30H
InChIKeyHPQKPQJSDCKZFL-UHFFFAOYSA-N
XLogP45.74
TPSA153.18 Ų
H-Bond Donors
H-Bond Acceptors13
Rotatable Bonds21
Heavy Atoms197
Complexity—

Lipinski Rule of Five

3 violations

RuleValue
MW ≤ 5002525.05
LogP ≤ 545.74
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 1013

Analyze 4-dibenzofuran-4-yl-2-phenyl-6-[3-(9-phenylxanthen-9-yl)phenyl]pyrimidine;2-naphthalen-2-yl-4-phenyl-6-[3-(9-phenylxanthen-9-yl)phenyl]pyrimidine;4-naphthalen-1-yl-2-phenyl-6-[3-(9-phenylxanthen-9-yl)phenyl]pyrimidine;4-phenyl-2-(2-phenylphenyl)-6-[3-(9-phenylxanthen-9-yl)phenyl]pyrimidine with MolForge

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Related Compounds

4-dibenzofuran-4-yl-6-phenyl-2-[4-(9-phenylxanthen-9-yl)phenyl]pyrimidine;4-naphthalen-1-yl-6-phenyl-2-[4-(9-phenylxanthen-9-yl)phenyl]pyrimidine;4-naphthalen-2-yl-6-phenyl-2-[4-(9-phenylxanthen-9-yl)phenyl]pyrimidine;4-phenyl-6-(2-phenylphenyl)-2-[4-(9-phenylxanthen-9-yl)phenyl]pyrimidine
CID 158876766
4-dibenzofuran-3-yl-6-phenyl-2-[2-[4-(9-phenylxanthen-9-yl)phenyl]phenyl]pyrimidine;4,6-diphenyl-2-[3-[3-[4-(9-phenylxanthen-9-yl)phenyl]phenyl]phenyl]pyrimidine;4-phenanthren-2-yl-6-phenyl-2-[2-[4-(9-phenylxanthen-9-yl)phenyl]phenyl]pyrimidine
CID 159628481
4-dibenzofuran-3-yl-2-phenyl-6-(2-spiro[fluorene-9,9'-xanthene]-3'-ylphenyl)pyrimidine;4-naphthalen-1-yl-2-phenyl-6-(2-spiro[fluorene-9,9'-xanthene]-3'-ylphenyl)pyrimidine;4-naphthalen-2-yl-2-phenyl-6-(2-spiro[fluorene-9,9'-xanthene]-3'-ylphenyl)pyrimidine;2-phenyl-4-(4-phenylnaphthalen-1-yl)-6-(2-spiro[fluorene-9,9'-xanthene]-3'-ylphenyl)pyrimidine
CID 158777118
4-dibenzofuran-4-yl-2-phenyl-6-[3-[3-(9-phenylfluoren-9-yl)phenyl]phenyl]pyrimidine
CID 171603443
2-dibenzofuran-3-yl-4-phenyl-6-spiro[fluorene-9,9'-xanthene]-2'-yl-1,3,5-triazine;bis(2-naphthalen-1-yl-4-phenyl-6-spiro[fluorene-9,9'-xanthene]-2'-yl-1,3,5-triazine);2-naphthalen-2-yl-4-phenyl-6-spiro[fluorene-9,9'-xanthene]-2'-yl-1,3,5-triazine;2-phenyl-4-(2-phenylphenyl)-6-spiro[fluorene-9,9'-xanthene]-2'-yl-1,3,5-triazine
CID 160832249
4-dibenzofuran-4-yl-6-(9,9-diphenylfluoren-2-yl)-2-naphthalen-1-ylpyrimidine
CID 171602380
4-dibenzofuran-4-yl-6-(2-phenylphenyl)-2-spiro[fluorene-9,9'-xanthene]-3-ylpyrimidine
CID 167348999
2-dibenzofuran-4-yl-4-(2-phenylphenyl)-6-spiro[fluorene-9,9'-xanthene]-2-yl-1,3,5-triazine
CID 167349084
4-[4-(4-dibenzofuran-4-ylphenyl)phenyl]-6-naphthalen-2-yl-2-phenylpyrimidine
CID 121460850
4-dibenzofuran-4-yl-2-phenyl-6-(5,9,9-triphenylfluoren-2-yl)pyrimidine
CID 171601946
4-(3-dibenzofuran-4-ylphenyl)-2-phenyl-6-[2-[4-(9-phenylfluoren-9-yl)phenyl]phenyl]pyrimidine
CID 171603283
4-dibenzofuran-3-yl-6-[4-(4-dibenzofuran-4-ylphenyl)phenyl]-2-phenylpyrimidine;4-[4-(4-dibenzofuran-4-ylphenyl)phenyl]-6-(9,9-dimethylfluoren-2-yl)-2-phenylpyrimidine;4-[4-(4-dibenzofuran-4-ylphenyl)phenyl]-6-naphthalen-1-yl-2-phenylpyrimidine;4-[4-(4-dibenzofuran-4-ylphenyl)phenyl]-6-naphthalen-2-yl-2-phenylpyrimidine
CID 159000045

Frequently Asked Questions

What is the IUPAC name of 4-dibenzofuran-4-yl-2-phenyl-6-[3-(9-phenylxanthen-9-yl)phenyl]pyrimidine;2-naphthalen-2-yl-4-phenyl-6-[3-(9-phenylxanthen-9-yl)phenyl]pyrimidine;4-naphthalen-1-yl-2-phenyl-6-[3-(9-phenylxanthen-9-yl)phenyl]pyrimidine;4-phenyl-2-(2-phenylphenyl)-6-[3-(9-phenylxanthen-9-yl)phenyl]pyrimidine?
The IUPAC name of 4-dibenzofuran-4-yl-2-phenyl-6-[3-(9-phenylxanthen-9-yl)phenyl]pyrimidine;2-naphthalen-2-yl-4-phenyl-6-[3-(9-phenylxanthen-9-yl)phenyl]pyrimidine;4-naphthalen-1-yl-2-phenyl-6-[3-(9-phenylxanthen-9-yl)phenyl]pyrimidine;4-phenyl-2-(2-phenylphenyl)-6-[3-(9-phenylxanthen-9-yl)phenyl]pyrimidine (CID 158550405) is 4-dibenzofuran-4-yl-2-phenyl-6-[3-(9-phenylxanthen-9-yl)phenyl]pyrimidine;2-naphthalen-2-yl-4-phenyl-6-[3-(9-phenylxanthen-9-yl)phenyl]pyrimidine;4-naphthalen-1-yl-2-phenyl-6-[3-(9-phenylxanthen-9-yl)phenyl]pyrimidine;4-phenyl-2-(2-phenylphenyl)-6-[3-(9-phenylxanthen-9-yl)phenyl]pyrimidine.
What is the SMILES notation for 4-dibenzofuran-4-yl-2-phenyl-6-[3-(9-phenylxanthen-9-yl)phenyl]pyrimidine;2-naphthalen-2-yl-4-phenyl-6-[3-(9-phenylxanthen-9-yl)phenyl]pyrimidine;4-naphthalen-1-yl-2-phenyl-6-[3-(9-phenylxanthen-9-yl)phenyl]pyrimidine;4-phenyl-2-(2-phenylphenyl)-6-[3-(9-phenylxanthen-9-yl)phenyl]pyrimidine?
The canonical SMILES for 4-dibenzofuran-4-yl-2-phenyl-6-[3-(9-phenylxanthen-9-yl)phenyl]pyrimidine;2-naphthalen-2-yl-4-phenyl-6-[3-(9-phenylxanthen-9-yl)phenyl]pyrimidine;4-naphthalen-1-yl-2-phenyl-6-[3-(9-phenylxanthen-9-yl)phenyl]pyrimidine;4-phenyl-2-(2-phenylphenyl)-6-[3-(9-phenylxanthen-9-yl)phenyl]pyrimidine is c1ccc(-c2cc(-c3cccc(C4(c5ccccc5)c5ccccc5Oc5ccccc54)c3)nc(-c3ccc4ccccc4c3)n2)cc1.c1ccc(-c2cc(-c3cccc(C4(c5ccccc5)c5ccccc5Oc5ccccc54)c3)nc(-c3ccccc3-c3ccccc3)n2)cc1.c1ccc(-c2nc(-c3cccc(C4(c5ccccc5)c5ccccc5Oc5ccccc54)c3)cc(-c3cccc4c3oc3ccccc34)n2)cc1.c1ccc(-c2nc(-c3cccc(C4(c5ccccc5)c5ccccc5Oc5ccccc54)c3)cc(-c3cccc4ccccc34)n2)cc1.
What is the InChIKey of 4-dibenzofuran-4-yl-2-phenyl-6-[3-(9-phenylxanthen-9-yl)phenyl]pyrimidine;2-naphthalen-2-yl-4-phenyl-6-[3-(9-phenylxanthen-9-yl)phenyl]pyrimidine;4-naphthalen-1-yl-2-phenyl-6-[3-(9-phenylxanthen-9-yl)phenyl]pyrimidine;4-phenyl-2-(2-phenylphenyl)-6-[3-(9-phenylxanthen-9-yl)phenyl]pyrimidine?
The InChIKey is HPQKPQJSDCKZFL-UHFFFAOYSA-N. The full InChI is InChI=1S/C47H30N2O2.C47H32N2O.2C45H30N2O/c1-3-15-31(16-4-1)46-48-40(30-41(49-46)37-23-14-22-36-35-21-7-10-26-42(35)51-45(36)37)32-17-13-20-34(29-32)47(33-18-5-2-6-19-33)38-24-8-11-27-43(38)50-44-28-12-9-25-39(44)47;1-4-17-33(18-5-1)38-25-10-11-26-39(38)46-48-42(34-19-6-2-7-20-34)32-43(49-46)35-21-16-24-37(31-35)47(36-22-8-3-9-23-36)40-27-12-14-29-44(40)50-45-30-15-13-28-41(45)47;1-3-16-32(17-4-1)44-46-40(30-41(47-44)37-24-14-18-31-15-7-8-23-36(31)37)33-19-13-22-35(29-33)45(34-20-5-2-6-21-34)38-25-9-11-27-42(38)48-43-28-12-10-26-39(43)45;1-3-15-32(16-4-1)40-30-41(47-44(46-40)35-27-26-31-14-7-8-17-33(31)28-35)34-18-13-21-37(29-34)45(36-19-5-2-6-20-36)38-22-9-11-24-42(38)48-43-25-12-10-23-39(43)45/h1-30H;1-32H;2*1-30H.
What are the key properties of 4-dibenzofuran-4-yl-2-phenyl-6-[3-(9-phenylxanthen-9-yl)phenyl]pyrimidine;2-naphthalen-2-yl-4-phenyl-6-[3-(9-phenylxanthen-9-yl)phenyl]pyrimidine;4-naphthalen-1-yl-2-phenyl-6-[3-(9-phenylxanthen-9-yl)phenyl]pyrimidine;4-phenyl-2-(2-phenylphenyl)-6-[3-(9-phenylxanthen-9-yl)phenyl]pyrimidine?
4-dibenzofuran-4-yl-2-phenyl-6-[3-(9-phenylxanthen-9-yl)phenyl]pyrimidine;2-naphthalen-2-yl-4-phenyl-6-[3-(9-phenylxanthen-9-yl)phenyl]pyrimidine;4-naphthalen-1-yl-2-phenyl-6-[3-(9-phenylxanthen-9-yl)phenyl]pyrimidine;4-phenyl-2-(2-phenylphenyl)-6-[3-(9-phenylxanthen-9-yl)phenyl]pyrimidine has a molecular weight of 2525.05 g/mol, XLogP of 45.74, 21 rotatable bonds, 0 hydrogen bond donors, and 13 hydrogen bond acceptors.
Where does this data come from?
All data for 4-dibenzofuran-4-yl-2-phenyl-6-[3-(9-phenylxanthen-9-yl)phenyl]pyrimidine;2-naphthalen-2-yl-4-phenyl-6-[3-(9-phenylxanthen-9-yl)phenyl]pyrimidine;4-naphthalen-1-yl-2-phenyl-6-[3-(9-phenylxanthen-9-yl)phenyl]pyrimidine;4-phenyl-2-(2-phenylphenyl)-6-[3-(9-phenylxanthen-9-yl)phenyl]pyrimidine is sourced from PubChem (CID 158550405), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).