9-[4-[4-(4-naphthalen-1-ylphenyl)-6-(2,3,4,5,6-pentadeuteriophenyl)-1,3,5-triazin-2-yl]-9-phenyldibenzofuran-2-yl]carbazole;9-[4-[4-(2,3,4,5,6-pentadeuteriophenyl)-6-[4-(4-phenylphenyl)phenyl]-1,3,5-triazin-2-yl]-9-phenyldibenzofuran-2-yl]carbazole;9-[4-[4-(2,3,4,5,6-pentadeuteriophenyl)-6-triphenylen-2-yl-1,3,5-triazin-2-yl]-9-phenyldibenzofuran-2-yl]carbazole

C169H104N12O3 — CID 163936067

IUPAC9-[4-[4-(4-naphthalen-1-ylphenyl)-6-(2,3,4,5,6-pentadeuteriophenyl)-1,3,5-triazin-2-yl]-9-phenyldibenzofuran-2-yl]carbazole;9-[4-[4-(2,3,4,5,6-pentadeuteriophenyl)-6-[4-(4-phenylphenyl)phenyl]-1,3,5-triazin-2-yl]-9-phenyldibenzofuran-2-yl]carbazole;9-[4-[4-(2,3,4,5,6-pentadeuteriophenyl)-6-triphenylen-2-yl-1,3,5-triazin-2-yl]-9-phenyldibenzofuran-2-yl]carbazole
SMILES[2H]c1c([2H])c([2H])c(-c2nc(-c3ccc(-c4ccc(-c5ccccc5)cc4)cc3)nc(-c3cc(-n4c5ccccc5c5ccccc54)cc4c3oc3cccc(-c5ccccc5)c34)n2)c([2H])c1[2H].[2H]c1c([2H])c([2H])c(-c2nc(-c3ccc(-c4cccc5ccccc45)cc3)nc(-c3cc(-n4c5ccccc5c5ccccc54)cc4c3oc3cccc(-c5ccccc5)c34)n2)c([2H])c1[2H].[2H]c1c([2H])c([2H])c(-c2nc(-c3ccc4c5ccccc5c5ccccc5c4c3)nc(-c3cc(-n4c5ccccc5c5ccccc54)cc4c3oc3cccc(-c5ccccc5)c34)n2)c([2H])c1[2H]
InChIInChI=1S/C57H34N4O.C57H36N4O.C55H34N4O/c1-3-16-35(17-4-1)39-26-15-29-52-53(39)48-33-38(61-50-27-13-11-24-45(50)46-25-12-14-28-51(46)61)34-49(54(48)62-52)57-59-55(36-18-5-2-6-19-36)58-56(60-57)37-30-31-44-42-22-8-7-20-40(42)41-21-9-10-23-43(41)47(44)32-37;1-4-15-37(16-5-1)38-27-29-39(30-28-38)40-31-33-43(34-32-40)56-58-55(42-19-8-3-9-20-42)59-57(60-56)49-36-44(61-50-24-12-10-21-46(50)47-22-11-13-25-51(47)61)35-48-53-45(41-17-6-2-7-18-41)23-14-26-52(53)62-54(48)49;1-3-15-36(16-4-1)43-25-14-28-50-51(43)46-33-40(59-48-26-11-9-22-44(48)45-23-10-12-27-49(45)59)34-47(52(46)60-50)55-57-53(38-18-5-2-6-19-38)56-54(58-55)39-31-29-37(30-32-39)42-24-13-20-35-17-7-8-21-41(35)42/h1-34H;1-36H;1-34H/i2D,5D,6D,18D,19D;3D,8D,9D,19D,20D;2D,5D,6D,18D,19D
InChIKeyRMXHMBIYFZHVPC-JBNCDIDASA-N
MW2365.86 g/mol
LogP44.22
Rot. Bonds18

About 9-[4-[4-(4-naphthalen-1-ylphenyl)-6-(2,3,4,5,6-pentadeuteriophenyl)-1,3,5-triazin-2-yl]-9-phenyldibenzofuran-2-yl]carbazole;9-[4-[4-(2,3,4,5,6-pentadeuteriophenyl)-6-[4-(4-phenylphenyl)phenyl]-1,3,5-triazin-2-yl]-9-phenyldibenzofuran-2-yl]carbazole;9-[4-[4-(2,3,4,5,6-pentadeuteriophenyl)-6-triphenylen-2-yl-1,3,5-triazin-2-yl]-9-phenyldibenzofuran-2-yl]carbazole

9-[4-[4-(4-naphthalen-1-ylphenyl)-6-(2,3,4,5,6-pentadeuteriophenyl)-1,3,5-triazin-2-yl]-9-phenyldibenzofuran-2-yl]carbazole;9-[4-[4-(2,3,4,5,6-pentadeuteriophenyl)-6-[4-(4-phenylphenyl)phenyl]-1,3,5-triazin-2-yl]-9-phenyldibenzofuran-2-yl]carbazole;9-[4-[4-(2,3,4,5,6-pentadeuteriophenyl)-6-triphenylen-2-yl-1,3,5-triazin-2-yl]-9-phenyldibenzofuran-2-yl]carbazole (PubChem CID 163936067) has the molecular formula C169H104N12O3 and a molecular weight of 2365.86 g/mol. Its IUPAC name is 9-[4-[4-(4-naphthalen-1-ylphenyl)-6-(2,3,4,5,6-pentadeuteriophenyl)-1,3,5-triazin-2-yl]-9-phenyldibenzofuran-2-yl]carbazole;9-[4-[4-(2,3,4,5,6-pentadeuteriophenyl)-6-[4-(4-phenylphenyl)phenyl]-1,3,5-triazin-2-yl]-9-phenyldibenzofuran-2-yl]carbazole;9-[4-[4-(2,3,4,5,6-pentadeuteriophenyl)-6-triphenylen-2-yl-1,3,5-triazin-2-yl]-9-phenyldibenzofuran-2-yl]carbazole.

Molecular Properties

Compound Name9-[4-[4-(4-naphthalen-1-ylphenyl)-6-(2,3,4,5,6-pentadeuteriophenyl)-1,3,5-triazin-2-yl]-9-phenyldibenzofuran-2-yl]carbazole;9-[4-[4-(2,3,4,5,6-pentadeuteriophenyl)-6-[4-(4-phenylphenyl)phenyl]-1,3,5-triazin-2-yl]-9-phenyldibenzofuran-2-yl]carbazole;9-[4-[4-(2,3,4,5,6-pentadeuteriophenyl)-6-triphenylen-2-yl-1,3,5-triazin-2-yl]-9-phenyldibenzofuran-2-yl]carbazole
PubChem CID163936067
Molecular FormulaC169H104N12O3
Molecular Weight2365.86 g/mol
Exact Mass2363.93
IUPAC Name9-[4-[4-(4-naphthalen-1-ylphenyl)-6-(2,3,4,5,6-pentadeuteriophenyl)-1,3,5-triazin-2-yl]-9-phenyldibenzofuran-2-yl]carbazole;9-[4-[4-(2,3,4,5,6-pentadeuteriophenyl)-6-[4-(4-phenylphenyl)phenyl]-1,3,5-triazin-2-yl]-9-phenyldibenzofuran-2-yl]carbazole;9-[4-[4-(2,3,4,5,6-pentadeuteriophenyl)-6-triphenylen-2-yl-1,3,5-triazin-2-yl]-9-phenyldibenzofuran-2-yl]carbazole
SMILES[2H]c1c([2H])c([2H])c(-c2nc(-c3ccc(-c4ccc(-c5ccccc5)cc4)cc3)nc(-c3cc(-n4c5ccccc5c5ccccc54)cc4c3oc3cccc(-c5ccccc5)c34)n2)c([2H])c1[2H].[2H]c1c([2H])c([2H])c(-c2nc(-c3ccc(-c4cccc5ccccc45)cc3)nc(-c3cc(-n4c5ccccc5c5ccccc54)cc4c3oc3cccc(-c5ccccc5)c34)n2)c([2H])c1[2H].[2H]c1c([2H])c([2H])c(-c2nc(-c3ccc4c5ccccc5c5ccccc5c4c3)nc(-c3cc(-n4c5ccccc5c5ccccc54)cc4c3oc3cccc(-c5ccccc5)c34)n2)c([2H])c1[2H]
InChIInChI=1S/C57H34N4O.C57H36N4O.C55H34N4O/c1-3-16-35(17-4-1)39-26-15-29-52-53(39)48-33-38(61-50-27-13-11-24-45(50)46-25-12-14-28-51(46)61)34-49(54(48)62-52)57-59-55(36-18-5-2-6-19-36)58-56(60-57)37-30-31-44-42-22-8-7-20-40(42)41-21-9-10-23-43(41)47(44)32-37;1-4-15-37(16-5-1)38-27-29-39(30-28-38)40-31-33-43(34-32-40)56-58-55(42-19-8-3-9-20-42)59-57(60-56)49-36-44(61-50-24-12-10-21-46(50)47-22-11-13-25-51(47)61)35-48-53-45(41-17-6-2-7-18-41)23-14-26-52(53)62-54(48)49;1-3-15-36(16-4-1)43-25-14-28-50-51(43)46-33-40(59-48-26-11-9-22-44(48)45-23-10-12-27-49(45)59)34-47(52(46)60-50)55-57-53(38-18-5-2-6-19-38)56-54(58-55)39-31-29-37(30-32-39)42-24-13-20-35-17-7-8-21-41(35)42/h1-34H;1-36H;1-34H/i2D,5D,6D,18D,19D;3D,8D,9D,19D,20D;2D,5D,6D,18D,19D
InChIKeyRMXHMBIYFZHVPC-JBNCDIDASA-N
XLogP44.22
TPSA170.22 Ų
H-Bond Donors
H-Bond Acceptors15
Rotatable Bonds18
Heavy Atoms184
Complexity—

Lipinski Rule of Five

3 violations

RuleValue
MW ≤ 5002365.86
LogP ≤ 544.22
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 1015

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'Polycyclic_aromatic_hydrocarbon_3', 'substructure': 'N/A'}

Analyze 9-[4-[4-(4-naphthalen-1-ylphenyl)-6-(2,3,4,5,6-pentadeuteriophenyl)-1,3,5-triazin-2-yl]-9-phenyldibenzofuran-2-yl]carbazole;9-[4-[4-(2,3,4,5,6-pentadeuteriophenyl)-6-[4-(4-phenylphenyl)phenyl]-1,3,5-triazin-2-yl]-9-phenyldibenzofuran-2-yl]carbazole;9-[4-[4-(2,3,4,5,6-pentadeuteriophenyl)-6-triphenylen-2-yl-1,3,5-triazin-2-yl]-9-phenyldibenzofuran-2-yl]carbazole with MolForge

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Related Compounds

9-[4-[4-(2,3,4,5,6-pentadeuteriophenyl)-6-triphenylen-2-yl-1,3,5-triazin-2-yl]-9-phenyldibenzofuran-2-yl]carbazole
CID 162780378
9-[4-[4-(2,3,4,5,6-pentadeuteriophenyl)-6-phenanthren-2-yl-1,3,5-triazin-2-yl]-9-(3-phenylphenyl)dibenzofuran-2-yl]carbazole
CID 162780447
9-[4-[4-(2,3,4,5,6-pentadeuteriophenyl)-6-phenyl-1,3,5-triazin-2-yl]-6-triphenylen-2-yldibenzofuran-2-yl]carbazole
CID 162780704
9-[8-(2,3,4,5,6-pentadeuteriophenyl)-4-[4-phenyl-6-(3-phenylphenyl)-1,3,5-triazin-2-yl]dibenzofuran-2-yl]carbazole;9-[4-[4-[4-(2,3,4,5,6-pentadeuteriophenyl)phenyl]-6-phenyl-1,3,5-triazin-2-yl]-8-phenyldibenzofuran-2-yl]carbazole;9-[4-[4-(2,3,4,5,6-pentadeuteriophenyl)-6-phenyl-1,3,5-triazin-2-yl]-8-phenyldibenzofuran-2-yl]carbazole
CID 163443706
9-[4-[4-(2,3,4,5,6-pentadeuteriophenyl)-6-phenyl-1,3,5-triazin-2-yl]-8-phenanthren-2-yldibenzofuran-2-yl]carbazole
CID 162780689
9-[4-[4-(2,3,4,5,6-pentadeuteriophenyl)-6-phenyl-1,3,5-triazin-2-yl]-6-phenyldibenzofuran-2-yl]carbazole
CID 162780675
9-[9-[4-(2,3,4,5,6-pentadeuteriophenyl)-6-phenyl-1,3,5-triazin-2-yl]dibenzofuran-2-yl]-2-phenylcarbazole
CID 169059424
9-[4-[4-(2,3,4,5,6-pentadeuteriophenyl)-6-phenanthren-9-yl-1,3,5-triazin-2-yl]-7-phenyldibenzofuran-2-yl]carbazole
CID 162780361
9-[4-phenyl-9-[4-phenyl-6-(3-phenylphenyl)-1,3,5-triazin-2-yl]dibenzofuran-2-yl]carbazole
CID 166495968
2-[6-(4-naphthalen-1-ylphenyl)dibenzofuran-1-yl]-4-(2,3,4,5,6-pentadeuteriophenyl)-6-(4-phenylphenyl)-1,3,5-triazine
CID 164808413
3-[9-[4-(2,3,4,5,6-pentadeuteriophenyl)-6-phenyl-1,3,5-triazin-2-yl]dibenzofuran-4-yl]-9-phenylcarbazole
CID 168770588
3-[4-[6-(2,3,4,5,6-pentadeuteriophenyl)dibenzofuran-1-yl]-6-phenyl-1,3,5-triazin-2-yl]-9-phenylcarbazole
CID 171050621

Frequently Asked Questions

What is the IUPAC name of 9-[4-[4-(4-naphthalen-1-ylphenyl)-6-(2,3,4,5,6-pentadeuteriophenyl)-1,3,5-triazin-2-yl]-9-phenyldibenzofuran-2-yl]carbazole;9-[4-[4-(2,3,4,5,6-pentadeuteriophenyl)-6-[4-(4-phenylphenyl)phenyl]-1,3,5-triazin-2-yl]-9-phenyldibenzofuran-2-yl]carbazole;9-[4-[4-(2,3,4,5,6-pentadeuteriophenyl)-6-triphenylen-2-yl-1,3,5-triazin-2-yl]-9-phenyldibenzofuran-2-yl]carbazole?
The IUPAC name of 9-[4-[4-(4-naphthalen-1-ylphenyl)-6-(2,3,4,5,6-pentadeuteriophenyl)-1,3,5-triazin-2-yl]-9-phenyldibenzofuran-2-yl]carbazole;9-[4-[4-(2,3,4,5,6-pentadeuteriophenyl)-6-[4-(4-phenylphenyl)phenyl]-1,3,5-triazin-2-yl]-9-phenyldibenzofuran-2-yl]carbazole;9-[4-[4-(2,3,4,5,6-pentadeuteriophenyl)-6-triphenylen-2-yl-1,3,5-triazin-2-yl]-9-phenyldibenzofuran-2-yl]carbazole (CID 163936067) is 9-[4-[4-(4-naphthalen-1-ylphenyl)-6-(2,3,4,5,6-pentadeuteriophenyl)-1,3,5-triazin-2-yl]-9-phenyldibenzofuran-2-yl]carbazole;9-[4-[4-(2,3,4,5,6-pentadeuteriophenyl)-6-[4-(4-phenylphenyl)phenyl]-1,3,5-triazin-2-yl]-9-phenyldibenzofuran-2-yl]carbazole;9-[4-[4-(2,3,4,5,6-pentadeuteriophenyl)-6-triphenylen-2-yl-1,3,5-triazin-2-yl]-9-phenyldibenzofuran-2-yl]carbazole.
What is the SMILES notation for 9-[4-[4-(4-naphthalen-1-ylphenyl)-6-(2,3,4,5,6-pentadeuteriophenyl)-1,3,5-triazin-2-yl]-9-phenyldibenzofuran-2-yl]carbazole;9-[4-[4-(2,3,4,5,6-pentadeuteriophenyl)-6-[4-(4-phenylphenyl)phenyl]-1,3,5-triazin-2-yl]-9-phenyldibenzofuran-2-yl]carbazole;9-[4-[4-(2,3,4,5,6-pentadeuteriophenyl)-6-triphenylen-2-yl-1,3,5-triazin-2-yl]-9-phenyldibenzofuran-2-yl]carbazole?
The canonical SMILES for 9-[4-[4-(4-naphthalen-1-ylphenyl)-6-(2,3,4,5,6-pentadeuteriophenyl)-1,3,5-triazin-2-yl]-9-phenyldibenzofuran-2-yl]carbazole;9-[4-[4-(2,3,4,5,6-pentadeuteriophenyl)-6-[4-(4-phenylphenyl)phenyl]-1,3,5-triazin-2-yl]-9-phenyldibenzofuran-2-yl]carbazole;9-[4-[4-(2,3,4,5,6-pentadeuteriophenyl)-6-triphenylen-2-yl-1,3,5-triazin-2-yl]-9-phenyldibenzofuran-2-yl]carbazole is [2H]c1c([2H])c([2H])c(-c2nc(-c3ccc(-c4ccc(-c5ccccc5)cc4)cc3)nc(-c3cc(-n4c5ccccc5c5ccccc54)cc4c3oc3cccc(-c5ccccc5)c34)n2)c([2H])c1[2H].[2H]c1c([2H])c([2H])c(-c2nc(-c3ccc(-c4cccc5ccccc45)cc3)nc(-c3cc(-n4c5ccccc5c5ccccc54)cc4c3oc3cccc(-c5ccccc5)c34)n2)c([2H])c1[2H].[2H]c1c([2H])c([2H])c(-c2nc(-c3ccc4c5ccccc5c5ccccc5c4c3)nc(-c3cc(-n4c5ccccc5c5ccccc54)cc4c3oc3cccc(-c5ccccc5)c34)n2)c([2H])c1[2H].
What is the InChIKey of 9-[4-[4-(4-naphthalen-1-ylphenyl)-6-(2,3,4,5,6-pentadeuteriophenyl)-1,3,5-triazin-2-yl]-9-phenyldibenzofuran-2-yl]carbazole;9-[4-[4-(2,3,4,5,6-pentadeuteriophenyl)-6-[4-(4-phenylphenyl)phenyl]-1,3,5-triazin-2-yl]-9-phenyldibenzofuran-2-yl]carbazole;9-[4-[4-(2,3,4,5,6-pentadeuteriophenyl)-6-triphenylen-2-yl-1,3,5-triazin-2-yl]-9-phenyldibenzofuran-2-yl]carbazole?
The InChIKey is RMXHMBIYFZHVPC-JBNCDIDASA-N. The full InChI is InChI=1S/C57H34N4O.C57H36N4O.C55H34N4O/c1-3-16-35(17-4-1)39-26-15-29-52-53(39)48-33-38(61-50-27-13-11-24-45(50)46-25-12-14-28-51(46)61)34-49(54(48)62-52)57-59-55(36-18-5-2-6-19-36)58-56(60-57)37-30-31-44-42-22-8-7-20-40(42)41-21-9-10-23-43(41)47(44)32-37;1-4-15-37(16-5-1)38-27-29-39(30-28-38)40-31-33-43(34-32-40)56-58-55(42-19-8-3-9-20-42)59-57(60-56)49-36-44(61-50-24-12-10-21-46(50)47-22-11-13-25-51(47)61)35-48-53-45(41-17-6-2-7-18-41)23-14-26-52(53)62-54(48)49;1-3-15-36(16-4-1)43-25-14-28-50-51(43)46-33-40(59-48-26-11-9-22-44(48)45-23-10-12-27-49(45)59)34-47(52(46)60-50)55-57-53(38-18-5-2-6-19-38)56-54(58-55)39-31-29-37(30-32-39)42-24-13-20-35-17-7-8-21-41(35)42/h1-34H;1-36H;1-34H/i2D,5D,6D,18D,19D;3D,8D,9D,19D,20D;2D,5D,6D,18D,19D.
What are the key properties of 9-[4-[4-(4-naphthalen-1-ylphenyl)-6-(2,3,4,5,6-pentadeuteriophenyl)-1,3,5-triazin-2-yl]-9-phenyldibenzofuran-2-yl]carbazole;9-[4-[4-(2,3,4,5,6-pentadeuteriophenyl)-6-[4-(4-phenylphenyl)phenyl]-1,3,5-triazin-2-yl]-9-phenyldibenzofuran-2-yl]carbazole;9-[4-[4-(2,3,4,5,6-pentadeuteriophenyl)-6-triphenylen-2-yl-1,3,5-triazin-2-yl]-9-phenyldibenzofuran-2-yl]carbazole?
9-[4-[4-(4-naphthalen-1-ylphenyl)-6-(2,3,4,5,6-pentadeuteriophenyl)-1,3,5-triazin-2-yl]-9-phenyldibenzofuran-2-yl]carbazole;9-[4-[4-(2,3,4,5,6-pentadeuteriophenyl)-6-[4-(4-phenylphenyl)phenyl]-1,3,5-triazin-2-yl]-9-phenyldibenzofuran-2-yl]carbazole;9-[4-[4-(2,3,4,5,6-pentadeuteriophenyl)-6-triphenylen-2-yl-1,3,5-triazin-2-yl]-9-phenyldibenzofuran-2-yl]carbazole has a molecular weight of 2365.86 g/mol, XLogP of 44.22, 18 rotatable bonds, 0 hydrogen bond donors, and 15 hydrogen bond acceptors.
Where does this data come from?
All data for 9-[4-[4-(4-naphthalen-1-ylphenyl)-6-(2,3,4,5,6-pentadeuteriophenyl)-1,3,5-triazin-2-yl]-9-phenyldibenzofuran-2-yl]carbazole;9-[4-[4-(2,3,4,5,6-pentadeuteriophenyl)-6-[4-(4-phenylphenyl)phenyl]-1,3,5-triazin-2-yl]-9-phenyldibenzofuran-2-yl]carbazole;9-[4-[4-(2,3,4,5,6-pentadeuteriophenyl)-6-triphenylen-2-yl-1,3,5-triazin-2-yl]-9-phenyldibenzofuran-2-yl]carbazole is sourced from PubChem (CID 163936067), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).