2-dibenzofuran-3-yl-4-naphthalen-1-yl-6-[5-(6-phenyldibenzothiophen-4-yl)naphthalen-2-yl]-1,3,5-triazine;2-dibenzofuran-3-yl-4-(2,3,4,5,6-pentadeuteriophenyl)-6-[4-(6-phenyldibenzothiophen-4-yl)naphthalen-1-yl]-1,3,5-triazine;2-dibenzofuran-3-yl-4-[4-(6-phenyldibenzothiophen-4-yl)naphthalen-1-yl]-6-(2-phenylphenyl)-1,3,5-triazine

C157H93N9O3S3 — CID 161324131

IUPAC2-dibenzofuran-3-yl-4-naphthalen-1-yl-6-[5-(6-phenyldibenzothiophen-4-yl)naphthalen-2-yl]-1,3,5-triazine;2-dibenzofuran-3-yl-4-(2,3,4,5,6-pentadeuteriophenyl)-6-[4-(6-phenyldibenzothiophen-4-yl)naphthalen-1-yl]-1,3,5-triazine;2-dibenzofuran-3-yl-4-[4-(6-phenyldibenzothiophen-4-yl)naphthalen-1-yl]-6-(2-phenylphenyl)-1,3,5-triazine
SMILES[2H]c1c([2H])c([2H])c(-c2nc(-c3ccc4c(c3)oc3ccccc34)nc(-c3ccc(-c4cccc5c4sc4c(-c6ccccc6)cccc45)c4ccccc34)n2)c([2H])c1[2H].c1ccc(-c2cccc3c2sc2c(-c4cccc5cc(-c6nc(-c7ccc8c(c7)oc7ccccc78)nc(-c7cccc8ccccc78)n6)ccc45)cccc23)cc1.c1ccc(-c2ccccc2-c2nc(-c3ccc4c(c3)oc3ccccc34)nc(-c3ccc(-c4cccc5c4sc4c(-c6ccccc6)cccc45)c4ccccc34)n2)cc1
InChIInChI=1S/C55H33N3OS.C53H31N3OS.C49H29N3OS/c1-3-15-34(16-4-1)37-19-7-10-23-47(37)54-56-53(36-29-30-43-42-22-11-12-28-49(42)59-50(43)33-36)57-55(58-54)48-32-31-41(39-20-8-9-21-40(39)48)44-25-14-27-46-45-26-13-24-38(51(45)60-52(44)46)35-17-5-2-6-18-35;1-2-12-33(13-3-1)39-19-10-22-44-45-23-11-21-43(50(45)58-49(39)44)40-20-9-16-34-30-35(26-28-38(34)40)51-54-52(36-27-29-42-41-18-6-7-25-47(41)57-48(42)31-36)56-53(55-51)46-24-8-15-32-14-4-5-17-37(32)46;1-3-13-30(14-4-1)33-20-11-22-40-41-23-12-21-39(46(41)54-45(33)40)36-27-28-42(35-18-8-7-17-34(35)36)49-51-47(31-15-5-2-6-16-31)50-48(52-49)32-25-26-38-37-19-9-10-24-43(37)53-44(38)29-32/h1-33H;1-31H;1-29H/i;;2D,5D,6D,15D,16D
InChIKeyVKNQPKVYHKAEBE-HQPJVCOPSA-N
MW2254.76 g/mol
LogP43.70
Rot. Bonds16

About 2-dibenzofuran-3-yl-4-naphthalen-1-yl-6-[5-(6-phenyldibenzothiophen-4-yl)naphthalen-2-yl]-1,3,5-triazine;2-dibenzofuran-3-yl-4-(2,3,4,5,6-pentadeuteriophenyl)-6-[4-(6-phenyldibenzothiophen-4-yl)naphthalen-1-yl]-1,3,5-triazine;2-dibenzofuran-3-yl-4-[4-(6-phenyldibenzothiophen-4-yl)naphthalen-1-yl]-6-(2-phenylphenyl)-1,3,5-triazine

2-dibenzofuran-3-yl-4-naphthalen-1-yl-6-[5-(6-phenyldibenzothiophen-4-yl)naphthalen-2-yl]-1,3,5-triazine;2-dibenzofuran-3-yl-4-(2,3,4,5,6-pentadeuteriophenyl)-6-[4-(6-phenyldibenzothiophen-4-yl)naphthalen-1-yl]-1,3,5-triazine;2-dibenzofuran-3-yl-4-[4-(6-phenyldibenzothiophen-4-yl)naphthalen-1-yl]-6-(2-phenylphenyl)-1,3,5-triazine (PubChem CID 161324131) has the molecular formula C157H93N9O3S3 and a molecular weight of 2254.76 g/mol. Its IUPAC name is 2-dibenzofuran-3-yl-4-naphthalen-1-yl-6-[5-(6-phenyldibenzothiophen-4-yl)naphthalen-2-yl]-1,3,5-triazine;2-dibenzofuran-3-yl-4-(2,3,4,5,6-pentadeuteriophenyl)-6-[4-(6-phenyldibenzothiophen-4-yl)naphthalen-1-yl]-1,3,5-triazine;2-dibenzofuran-3-yl-4-[4-(6-phenyldibenzothiophen-4-yl)naphthalen-1-yl]-6-(2-phenylphenyl)-1,3,5-triazine.

Molecular Properties

Compound Name2-dibenzofuran-3-yl-4-naphthalen-1-yl-6-[5-(6-phenyldibenzothiophen-4-yl)naphthalen-2-yl]-1,3,5-triazine;2-dibenzofuran-3-yl-4-(2,3,4,5,6-pentadeuteriophenyl)-6-[4-(6-phenyldibenzothiophen-4-yl)naphthalen-1-yl]-1,3,5-triazine;2-dibenzofuran-3-yl-4-[4-(6-phenyldibenzothiophen-4-yl)naphthalen-1-yl]-6-(2-phenylphenyl)-1,3,5-triazine
PubChem CID161324131
Molecular FormulaC157H93N9O3S3
Molecular Weight2254.76 g/mol
Exact Mass2252.69
IUPAC Name2-dibenzofuran-3-yl-4-naphthalen-1-yl-6-[5-(6-phenyldibenzothiophen-4-yl)naphthalen-2-yl]-1,3,5-triazine;2-dibenzofuran-3-yl-4-(2,3,4,5,6-pentadeuteriophenyl)-6-[4-(6-phenyldibenzothiophen-4-yl)naphthalen-1-yl]-1,3,5-triazine;2-dibenzofuran-3-yl-4-[4-(6-phenyldibenzothiophen-4-yl)naphthalen-1-yl]-6-(2-phenylphenyl)-1,3,5-triazine
SMILES[2H]c1c([2H])c([2H])c(-c2nc(-c3ccc4c(c3)oc3ccccc34)nc(-c3ccc(-c4cccc5c4sc4c(-c6ccccc6)cccc45)c4ccccc34)n2)c([2H])c1[2H].c1ccc(-c2cccc3c2sc2c(-c4cccc5cc(-c6nc(-c7ccc8c(c7)oc7ccccc78)nc(-c7cccc8ccccc78)n6)ccc45)cccc23)cc1.c1ccc(-c2ccccc2-c2nc(-c3ccc4c(c3)oc3ccccc34)nc(-c3ccc(-c4cccc5c4sc4c(-c6ccccc6)cccc45)c4ccccc34)n2)cc1
InChIInChI=1S/C55H33N3OS.C53H31N3OS.C49H29N3OS/c1-3-15-34(16-4-1)37-19-7-10-23-47(37)54-56-53(36-29-30-43-42-22-11-12-28-49(42)59-50(43)33-36)57-55(58-54)48-32-31-41(39-20-8-9-21-40(39)48)44-25-14-27-46-45-26-13-24-38(51(45)60-52(44)46)35-17-5-2-6-18-35;1-2-12-33(13-3-1)39-19-10-22-44-45-23-11-21-43(50(45)58-49(39)44)40-20-9-16-34-30-35(26-28-38(34)40)51-54-52(36-27-29-42-41-18-6-7-25-47(41)57-48(42)31-36)56-53(55-51)46-24-8-15-32-14-4-5-17-37(32)46;1-3-13-30(14-4-1)33-20-11-22-40-41-23-12-21-39(46(41)54-45(33)40)36-27-28-42(35-18-8-7-17-34(35)36)49-51-47(31-15-5-2-6-16-31)50-48(52-49)32-25-26-38-37-19-9-10-24-43(37)53-44(38)29-32/h1-33H;1-31H;1-29H/i;;2D,5D,6D,15D,16D
InChIKeyVKNQPKVYHKAEBE-HQPJVCOPSA-N
XLogP43.70
TPSA155.43 Ų
H-Bond Donors
H-Bond Acceptors15
Rotatable Bonds16
Heavy Atoms172
Complexity—

Lipinski Rule of Five

3 violations

RuleValue
MW ≤ 5002254.76
LogP ≤ 543.70
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 1015

Analyze 2-dibenzofuran-3-yl-4-naphthalen-1-yl-6-[5-(6-phenyldibenzothiophen-4-yl)naphthalen-2-yl]-1,3,5-triazine;2-dibenzofuran-3-yl-4-(2,3,4,5,6-pentadeuteriophenyl)-6-[4-(6-phenyldibenzothiophen-4-yl)naphthalen-1-yl]-1,3,5-triazine;2-dibenzofuran-3-yl-4-[4-(6-phenyldibenzothiophen-4-yl)naphthalen-1-yl]-6-(2-phenylphenyl)-1,3,5-triazine with MolForge

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Related Compounds

2-dibenzofuran-3-yl-4-naphthalen-1-yl-6-[3-phenyl-5-(6-phenyldibenzothiophen-4-yl)phenyl]-1,3,5-triazine;2-dibenzofuran-3-yl-4-(2,3,4,5,6-pentadeuteriophenyl)-6-[4-(6-phenyldibenzothiophen-4-yl)naphthalen-2-yl]-1,3,5-triazine;2-dibenzofuran-3-yl-4-[4-(6-phenyldibenzothiophen-4-yl)naphthalen-2-yl]-6-(2-phenylphenyl)-1,3,5-triazine
CID 159487752
2-dibenzofuran-3-yl-4-naphthalen-1-yl-6-[3-phenyl-5-(6-phenyldibenzothiophen-4-yl)phenyl]-1,3,5-triazine;2-dibenzofuran-3-yl-4-(2,3,4,5,6-pentadeuteriophenyl)-6-[4-(6-phenyldibenzothiophen-4-yl)naphthalen-2-yl]-1,3,5-triazine
CID 159674489
2-dibenzofuran-3-yl-4-naphthalen-1-yl-6-[3-[6-(2,3,4,5,6-pentadeuteriophenyl)dibenzothiophen-4-yl]naphthalen-1-yl]-1,3,5-triazine
CID 155773160
2-dibenzofuran-3-yl-4-[3-[6-(2,3,4,5,6-pentadeuteriophenyl)dibenzothiophen-4-yl]naphthalen-1-yl]-6-phenyl-1,3,5-triazine
CID 153494941
2-dibenzofuran-3-yl-4-(4-dibenzothiophen-4-ylnaphthalen-1-yl)-6-(2,3,4,5,6-pentadeuteriophenyl)-1,3,5-triazine;2-dibenzofuran-3-yl-4-(4-dibenzothiophen-4-ylnaphthalen-1-yl)-6-(2-phenylphenyl)-1,3,5-triazine;2-dibenzofuran-3-yl-4-(4-dibenzothiophen-4-ylnaphthalen-1-yl)-6-(3-phenylphenyl)-1,3,5-triazine
CID 159358952
2-dibenzofuran-3-yl-4-[4-[6-(2,3,4,5,6-pentadeuteriophenyl)dibenzothiophen-4-yl]-3-phenylphenyl]-6-phenyl-1,3,5-triazine
CID 153494950
2-dibenzofuran-3-yl-4-(4-dibenzothiophen-4-ylphenyl)-6-naphthalen-1-yl-1,3,5-triazine;2-dibenzofuran-3-yl-4-(4-dibenzothiophen-4-ylphenyl)-6-naphthalen-2-yl-1,3,5-triazine;2-dibenzofuran-3-yl-4-(4-dibenzothiophen-4-ylphenyl)-6-(2,3,4,5,6-pentadeuteriophenyl)-1,3,5-triazine;2-dibenzofuran-3-yl-4-(4-dibenzothiophen-4-ylphenyl)-6-(2-phenylphenyl)-1,3,5-triazine;2-dibenzofuran-3-yl-4-(4-dibenzothiophen-4-ylphenyl)-6-(3-phenylphenyl)-1,3,5-triazine;2-dibenzofuran-3-yl-4-(4-dibenzothiophen-4-ylphenyl)-6-(4-phenylphenyl)-1,3,5-triazine
CID 158294660
2-dibenzofuran-3-yl-4-(4-dibenzothiophen-4-ylnaphthalen-2-yl)-6-naphthalen-1-yl-1,3,5-triazine;2-dibenzofuran-3-yl-4-(4-dibenzothiophen-4-ylnaphthalen-2-yl)-6-naphthalen-2-yl-1,3,5-triazine;2-dibenzofuran-3-yl-4-(3-dibenzothiophen-4-ylnaphthalen-1-yl)-6-(2,3,4,5,6-pentadeuteriophenyl)-1,3,5-triazine;2-dibenzofuran-3-yl-4-(3-dibenzothiophen-4-ylnaphthalen-1-yl)-6-(2-phenylphenyl)-1,3,5-triazine;2-dibenzofuran-3-yl-4-(4-dibenzothiophen-4-ylnaphthalen-2-yl)-6-(3-phenylphenyl)-1,3,5-triazine;2-dibenzofuran-3-yl-4-(4-dibenzothiophen-4-ylnaphthalen-2-yl)-6-(4-phenylphenyl)-1,3,5-triazine
CID 160968932
2-dibenzofuran-3-yl-4-[3-[6-(2,3,4,5,6-pentadeuteriophenyl)dibenzothiophen-4-yl]phenyl]-6-(4-phenylphenyl)-1,3,5-triazine
CID 153494890
2-dibenzofuran-3-yl-4-naphthalen-1-yl-6-[4-(6-phenyldibenzothiophen-4-yl)naphthalen-2-yl]-1,3,5-triazine;2-dibenzofuran-3-yl-4-naphthalen-2-yl-6-[4-(6-phenyldibenzothiophen-4-yl)naphthalen-2-yl]-1,3,5-triazine;2-dibenzofuran-3-yl-4-[4-(6-phenyldibenzothiophen-4-yl)naphthalen-2-yl]-6-(4-phenylphenyl)-1,3,5-triazine
CID 161337871
2-dibenzofuran-3-yl-4-naphthalen-1-yl-6-[3-(6-phenyldibenzothiophen-4-yl)phenyl]-1,3,5-triazine;2-dibenzofuran-3-yl-4-naphthalen-2-yl-6-[3-(6-phenyldibenzothiophen-4-yl)phenyl]-1,3,5-triazine;2-dibenzofuran-3-yl-4-[3-(6-phenyldibenzothiophen-4-yl)phenyl]-6-(4-phenylphenyl)-1,3,5-triazine
CID 160738296
2-dibenzofuran-3-yl-4-phenyl-6-[1-(6-phenyldibenzothiophen-4-yl)phenanthren-4-yl]-1,3,5-triazine
CID 139404323

Frequently Asked Questions

What is the IUPAC name of 2-dibenzofuran-3-yl-4-naphthalen-1-yl-6-[5-(6-phenyldibenzothiophen-4-yl)naphthalen-2-yl]-1,3,5-triazine;2-dibenzofuran-3-yl-4-(2,3,4,5,6-pentadeuteriophenyl)-6-[4-(6-phenyldibenzothiophen-4-yl)naphthalen-1-yl]-1,3,5-triazine;2-dibenzofuran-3-yl-4-[4-(6-phenyldibenzothiophen-4-yl)naphthalen-1-yl]-6-(2-phenylphenyl)-1,3,5-triazine?
The IUPAC name of 2-dibenzofuran-3-yl-4-naphthalen-1-yl-6-[5-(6-phenyldibenzothiophen-4-yl)naphthalen-2-yl]-1,3,5-triazine;2-dibenzofuran-3-yl-4-(2,3,4,5,6-pentadeuteriophenyl)-6-[4-(6-phenyldibenzothiophen-4-yl)naphthalen-1-yl]-1,3,5-triazine;2-dibenzofuran-3-yl-4-[4-(6-phenyldibenzothiophen-4-yl)naphthalen-1-yl]-6-(2-phenylphenyl)-1,3,5-triazine (CID 161324131) is 2-dibenzofuran-3-yl-4-naphthalen-1-yl-6-[5-(6-phenyldibenzothiophen-4-yl)naphthalen-2-yl]-1,3,5-triazine;2-dibenzofuran-3-yl-4-(2,3,4,5,6-pentadeuteriophenyl)-6-[4-(6-phenyldibenzothiophen-4-yl)naphthalen-1-yl]-1,3,5-triazine;2-dibenzofuran-3-yl-4-[4-(6-phenyldibenzothiophen-4-yl)naphthalen-1-yl]-6-(2-phenylphenyl)-1,3,5-triazine.
What is the SMILES notation for 2-dibenzofuran-3-yl-4-naphthalen-1-yl-6-[5-(6-phenyldibenzothiophen-4-yl)naphthalen-2-yl]-1,3,5-triazine;2-dibenzofuran-3-yl-4-(2,3,4,5,6-pentadeuteriophenyl)-6-[4-(6-phenyldibenzothiophen-4-yl)naphthalen-1-yl]-1,3,5-triazine;2-dibenzofuran-3-yl-4-[4-(6-phenyldibenzothiophen-4-yl)naphthalen-1-yl]-6-(2-phenylphenyl)-1,3,5-triazine?
The canonical SMILES for 2-dibenzofuran-3-yl-4-naphthalen-1-yl-6-[5-(6-phenyldibenzothiophen-4-yl)naphthalen-2-yl]-1,3,5-triazine;2-dibenzofuran-3-yl-4-(2,3,4,5,6-pentadeuteriophenyl)-6-[4-(6-phenyldibenzothiophen-4-yl)naphthalen-1-yl]-1,3,5-triazine;2-dibenzofuran-3-yl-4-[4-(6-phenyldibenzothiophen-4-yl)naphthalen-1-yl]-6-(2-phenylphenyl)-1,3,5-triazine is [2H]c1c([2H])c([2H])c(-c2nc(-c3ccc4c(c3)oc3ccccc34)nc(-c3ccc(-c4cccc5c4sc4c(-c6ccccc6)cccc45)c4ccccc34)n2)c([2H])c1[2H].c1ccc(-c2cccc3c2sc2c(-c4cccc5cc(-c6nc(-c7ccc8c(c7)oc7ccccc78)nc(-c7cccc8ccccc78)n6)ccc45)cccc23)cc1.c1ccc(-c2ccccc2-c2nc(-c3ccc4c(c3)oc3ccccc34)nc(-c3ccc(-c4cccc5c4sc4c(-c6ccccc6)cccc45)c4ccccc34)n2)cc1.
What is the InChIKey of 2-dibenzofuran-3-yl-4-naphthalen-1-yl-6-[5-(6-phenyldibenzothiophen-4-yl)naphthalen-2-yl]-1,3,5-triazine;2-dibenzofuran-3-yl-4-(2,3,4,5,6-pentadeuteriophenyl)-6-[4-(6-phenyldibenzothiophen-4-yl)naphthalen-1-yl]-1,3,5-triazine;2-dibenzofuran-3-yl-4-[4-(6-phenyldibenzothiophen-4-yl)naphthalen-1-yl]-6-(2-phenylphenyl)-1,3,5-triazine?
The InChIKey is VKNQPKVYHKAEBE-HQPJVCOPSA-N. The full InChI is InChI=1S/C55H33N3OS.C53H31N3OS.C49H29N3OS/c1-3-15-34(16-4-1)37-19-7-10-23-47(37)54-56-53(36-29-30-43-42-22-11-12-28-49(42)59-50(43)33-36)57-55(58-54)48-32-31-41(39-20-8-9-21-40(39)48)44-25-14-27-46-45-26-13-24-38(51(45)60-52(44)46)35-17-5-2-6-18-35;1-2-12-33(13-3-1)39-19-10-22-44-45-23-11-21-43(50(45)58-49(39)44)40-20-9-16-34-30-35(26-28-38(34)40)51-54-52(36-27-29-42-41-18-6-7-25-47(41)57-48(42)31-36)56-53(55-51)46-24-8-15-32-14-4-5-17-37(32)46;1-3-13-30(14-4-1)33-20-11-22-40-41-23-12-21-39(46(41)54-45(33)40)36-27-28-42(35-18-8-7-17-34(35)36)49-51-47(31-15-5-2-6-16-31)50-48(52-49)32-25-26-38-37-19-9-10-24-43(37)53-44(38)29-32/h1-33H;1-31H;1-29H/i;;2D,5D,6D,15D,16D.
What are the key properties of 2-dibenzofuran-3-yl-4-naphthalen-1-yl-6-[5-(6-phenyldibenzothiophen-4-yl)naphthalen-2-yl]-1,3,5-triazine;2-dibenzofuran-3-yl-4-(2,3,4,5,6-pentadeuteriophenyl)-6-[4-(6-phenyldibenzothiophen-4-yl)naphthalen-1-yl]-1,3,5-triazine;2-dibenzofuran-3-yl-4-[4-(6-phenyldibenzothiophen-4-yl)naphthalen-1-yl]-6-(2-phenylphenyl)-1,3,5-triazine?
2-dibenzofuran-3-yl-4-naphthalen-1-yl-6-[5-(6-phenyldibenzothiophen-4-yl)naphthalen-2-yl]-1,3,5-triazine;2-dibenzofuran-3-yl-4-(2,3,4,5,6-pentadeuteriophenyl)-6-[4-(6-phenyldibenzothiophen-4-yl)naphthalen-1-yl]-1,3,5-triazine;2-dibenzofuran-3-yl-4-[4-(6-phenyldibenzothiophen-4-yl)naphthalen-1-yl]-6-(2-phenylphenyl)-1,3,5-triazine has a molecular weight of 2254.76 g/mol, XLogP of 43.70, 16 rotatable bonds, 0 hydrogen bond donors, and 15 hydrogen bond acceptors.
Where does this data come from?
All data for 2-dibenzofuran-3-yl-4-naphthalen-1-yl-6-[5-(6-phenyldibenzothiophen-4-yl)naphthalen-2-yl]-1,3,5-triazine;2-dibenzofuran-3-yl-4-(2,3,4,5,6-pentadeuteriophenyl)-6-[4-(6-phenyldibenzothiophen-4-yl)naphthalen-1-yl]-1,3,5-triazine;2-dibenzofuran-3-yl-4-[4-(6-phenyldibenzothiophen-4-yl)naphthalen-1-yl]-6-(2-phenylphenyl)-1,3,5-triazine is sourced from PubChem (CID 161324131), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).