12-[3-(4-dibenzofuran-3-yl-6-phenyl-1,3,5-triazin-2-yl)phenyl]-6-(6-isocyanonaphthalen-2-yl)naphtho[2,1-f]quinoline;12-[4-[3-(4-dibenzofuran-2-yl-6-phenyl-1,3,5-triazin-2-yl)phenyl]naphthalen-1-yl]-6-(4-isocyanophenyl)naphtho[2,1-f]quinoline;12-[4-[3-(4-dibenzofuran-3-yl-6-phenyl-1,3,5-triazin-2-yl)phenyl]naphthalen-1-yl]-6-(4-isocyanophenyl)naphtho[2,1-f]quinoline;12-[3-[3-(4-dibenzofuran-3-yl-6-phenyl-1,3,5-triazin-2-yl)phenyl]phenyl]-6-(4-isocyanophenyl)naphtho[2,1-f]quinoline

C234H134N20O4 — CID 165018862

About 12-[3-(4-dibenzofuran-3-yl-6-phenyl-1,3,5-triazin-2-yl)phenyl]-6-(6-isocyanonaphthalen-2-yl)naphtho[2,1-f]quinoline;12-[4-[3-(4-dibenzofuran-2-yl-6-phenyl-1,3,5-triazin-2-yl)phenyl]naphthalen-1-yl]-6-(4-isocyanophenyl)naphtho[2,1-f]quinoline;12-[4-[3-(4-dibenzofuran-3-yl-6-phenyl-1,3,5-triazin-2-yl)phenyl]naphthalen-1-yl]-6-(4-isocyanophenyl)naphtho[2,1-f]quinoline;12-[3-[3-(4-dibenzofuran-3-yl-6-phenyl-1,3,5-triazin-2-yl)phenyl]phenyl]-6-(4-isocyanophenyl)naphtho[2,1-f]quinoline

12-[3-(4-dibenzofuran-3-yl-6-phenyl-1,3,5-triazin-2-yl)phenyl]-6-(6-isocyanonaphthalen-2-yl)naphtho[2,1-f]quinoline;12-[4-[3-(4-dibenzofuran-2-yl-6-phenyl-1,3,5-triazin-2-yl)phenyl]naphthalen-1-yl]-6-(4-isocyanophenyl)naphtho[2,1-f]quinoline;12-[4-[3-(4-dibenzofuran-3-yl-6-phenyl-1,3,5-triazin-2-yl)phenyl]naphthalen-1-yl]-6-(4-isocyanophenyl)naphtho[2,1-f]quinoline;12-[3-[3-(4-dibenzofuran-3-yl-6-phenyl-1,3,5-triazin-2-yl)phenyl]phenyl]-6-(4-isocyanophenyl)naphtho[2,1-f]quinoline (PubChem CID 165018862) has the molecular formula C234H134N20O4 and a molecular weight of 3289.78 g/mol. Its IUPAC name is 12-[3-(4-dibenzofuran-3-yl-6-phenyl-1,3,5-triazin-2-yl)phenyl]-6-(6-isocyanonaphthalen-2-yl)naphtho[2,1-f]quinoline;12-[4-[3-(4-dibenzofuran-2-yl-6-phenyl-1,3,5-triazin-2-yl)phenyl]naphthalen-1-yl]-6-(4-isocyanophenyl)naphtho[2,1-f]quinoline;12-[4-[3-(4-dibenzofuran-3-yl-6-phenyl-1,3,5-triazin-2-yl)phenyl]naphthalen-1-yl]-6-(4-isocyanophenyl)naphtho[2,1-f]quinoline;12-[3-[3-(4-dibenzofuran-3-yl-6-phenyl-1,3,5-triazin-2-yl)phenyl]phenyl]-6-(4-isocyanophenyl)naphtho[2,1-f]quinoline.

Molecular Properties

• Compound Name: 12-[3-(4-dibenzofuran-3-yl-6-phenyl-1,3,5-triazin-2-yl)phenyl]-6-(6-isocyanonaphthalen-2-yl)naphtho[2,1-f]quinoline;12-[4-[3-(4-dibenzofuran-2-yl-6-phenyl-1,3,5-triazin-2-yl)phenyl]naphthalen-1-yl]-6-(4-isocyanophenyl)naphtho[2,1-f]quinoline;12-[4-[3-(4-dibenzofuran-3-yl-6-phenyl-1,3,5-triazin-2-yl)phenyl]naphthalen-1-yl]-6-(4-isocyanophenyl)naphtho[2,1-f]quinoline;12-[3-[3-(4-dibenzofuran-3-yl-6-phenyl-1,3,5-triazin-2-yl)phenyl]phenyl]-6-(4-isocyanophenyl)naphtho[2,1-f]quinoline
• PubChem CID: 165018862
• Molecular Formula: C234H134N20O4
• Molecular Weight: 3289.78 g/mol
• Exact Mass: 3287.09
• IUPAC Name: 12-[3-(4-dibenzofuran-3-yl-6-phenyl-1,3,5-triazin-2-yl)phenyl]-6-(6-isocyanonaphthalen-2-yl)naphtho[2,1-f]quinoline;12-[4-[3-(4-dibenzofuran-2-yl-6-phenyl-1,3,5-triazin-2-yl)phenyl]naphthalen-1-yl]-6-(4-isocyanophenyl)naphtho[2,1-f]quinoline;12-[4-[3-(4-dibenzofuran-3-yl-6-phenyl-1,3,5-triazin-2-yl)phenyl]naphthalen-1-yl]-6-(4-isocyanophenyl)naphtho[2,1-f]quinoline;12-[3-[3-(4-dibenzofuran-3-yl-6-phenyl-1,3,5-triazin-2-yl)phenyl]phenyl]-6-(4-isocyanophenyl)naphtho[2,1-f]quinoline
• SMILES: [C-]#[N+]c1ccc(-c2cc3c4cccnc4c(-c4ccc(-c5cccc(-c6nc(-c7ccccc7)nc(-c7ccc8c(c7)oc7ccccc78)n6)c5)c5ccccc45)cc3c3ccccc23)cc1.[C-]#[N+]c1ccc(-c2cc3c4cccnc4c(-c4ccc(-c5cccc(-c6nc(-c7ccccc7)nc(-c7ccc8oc9ccccc9c8c7)n6)c5)c5ccccc45)cc3c3ccccc23)cc1.[C-]#[N+]c1ccc(-c2cc3c4cccnc4c(-c4cccc(-c5cccc(-c6nc(-c7ccccc7)nc(-c7ccc8c(c7)oc7ccccc78)n6)c5)c4)cc3c3ccccc23)cc1.[C-]#[N+]c1ccc2cc(-c3cc4c5cccnc5c(-c5cccc(-c6nc(-c7ccccc7)nc(-c7ccc8c(c7)oc7ccccc78)n6)c5)cc4c4ccccc34)ccc2c1
• InChI: InChI=1S/2C61H35N5O.C57H33N5O.C55H31N5O/c1-62-42-27-24-37(25-28-42)51-35-53-50-22-12-32-63-58(50)55(36-52(53)47-20-8-7-19-46(47)51)48-30-29-43(44-17-5-6-18-45(44)48)39-15-11-16-40(33-39)60-64-59(38-13-3-2-4-14-38)65-61(66-60)41-26-31-57-54(34-41)49-21-9-10-23-56(49)67-57;1-62-42-27-24-37(25-28-42)52-35-54-51-22-12-32-63-58(51)55(36-53(54)47-20-8-7-19-46(47)52)48-31-30-43(44-17-5-6-18-45(44)48)39-15-11-16-40(33-39)60-64-59(38-13-3-2-4-14-38)65-61(66-60)41-26-29-50-49-21-9-10-23-56(49)67-57(50)34-41;1-58-42-26-23-35(24-27-42)48-33-51-47-21-11-29-59-54(47)49(34-50(51)44-19-6-5-18-43(44)48)39-16-9-14-37(30-39)38-15-10-17-40(31-38)56-60-55(36-12-3-2-4-13-36)61-57(62-56)41-25-28-46-45-20-7-8-22-52(45)63-53(46)32-41;1-56-40-24-22-34-27-37(21-20-35(34)29-40)46-31-49-45-18-10-26-57-52(45)47(32-48(49)42-16-6-5-15-41(42)46)36-13-9-14-38(28-36)54-58-53(33-11-3-2-4-12-33)59-55(60-54)39-23-25-44-43-17-7-8-19-50(43)61-51(44)30-39/h2*2-36H;2-34H;2-32H
• InChIKey: KVTCMIPMTNWPSY-UHFFFAOYSA-N
• XLogP: 62.51
• TPSA: 276.24 Ų
• H-Bond Acceptors: 20
• Rotatable Bonds: 23
• Heavy Atoms: 258
• Complexity: —

Lipinski Rule of Five

3 violations

Rule	Value
MW ≤ 500	3289.78
LogP ≤ 5	62.51
H-Bond Donors ≤ 5	0
H-Bond Acceptors ≤ 10	20

Computed Properties (RDKit)

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

Frequently Asked Questions

What is the IUPAC name of 12-[3-(4-dibenzofuran-3-yl-6-phenyl-1,3,5-triazin-2-yl)phenyl]-6-(6-isocyanonaphthalen-2-yl)naphtho[2,1-f]quinoline;12-[4-[3-(4-dibenzofuran-2-yl-6-phenyl-1,3,5-triazin-2-yl)phenyl]naphthalen-1-yl]-6-(4-isocyanophenyl)naphtho[2,1-f]quinoline;12-[4-[3-(4-dibenzofuran-3-yl-6-phenyl-1,3,5-triazin-2-yl)phenyl]naphthalen-1-yl]-6-(4-isocyanophenyl)naphtho[2,1-f]quinoline;12-[3-[3-(4-dibenzofuran-3-yl-6-phenyl-1,3,5-triazin-2-yl)phenyl]phenyl]-6-(4-isocyanophenyl)naphtho[2,1-f]quinoline?

The IUPAC name of 12-[3-(4-dibenzofuran-3-yl-6-phenyl-1,3,5-triazin-2-yl)phenyl]-6-(6-isocyanonaphthalen-2-yl)naphtho[2,1-f]quinoline;12-[4-[3-(4-dibenzofuran-2-yl-6-phenyl-1,3,5-triazin-2-yl)phenyl]naphthalen-1-yl]-6-(4-isocyanophenyl)naphtho[2,1-f]quinoline;12-[4-[3-(4-dibenzofuran-3-yl-6-phenyl-1,3,5-triazin-2-yl)phenyl]naphthalen-1-yl]-6-(4-isocyanophenyl)naphtho[2,1-f]quinoline;12-[3-[3-(4-dibenzofuran-3-yl-6-phenyl-1,3,5-triazin-2-yl)phenyl]phenyl]-6-(4-isocyanophenyl)naphtho[2,1-f]quinoline (CID 165018862) is 12-[3-(4-dibenzofuran-3-yl-6-phenyl-1,3,5-triazin-2-yl)phenyl]-6-(6-isocyanonaphthalen-2-yl)naphtho[2,1-f]quinoline;12-[4-[3-(4-dibenzofuran-2-yl-6-phenyl-1,3,5-triazin-2-yl)phenyl]naphthalen-1-yl]-6-(4-isocyanophenyl)naphtho[2,1-f]quinoline;12-[4-[3-(4-dibenzofuran-3-yl-6-phenyl-1,3,5-triazin-2-yl)phenyl]naphthalen-1-yl]-6-(4-isocyanophenyl)naphtho[2,1-f]quinoline;12-[3-[3-(4-dibenzofuran-3-yl-6-phenyl-1,3,5-triazin-2-yl)phenyl]phenyl]-6-(4-isocyanophenyl)naphtho[2,1-f]quinoline.

What is the SMILES notation for 12-[3-(4-dibenzofuran-3-yl-6-phenyl-1,3,5-triazin-2-yl)phenyl]-6-(6-isocyanonaphthalen-2-yl)naphtho[2,1-f]quinoline;12-[4-[3-(4-dibenzofuran-2-yl-6-phenyl-1,3,5-triazin-2-yl)phenyl]naphthalen-1-yl]-6-(4-isocyanophenyl)naphtho[2,1-f]quinoline;12-[4-[3-(4-dibenzofuran-3-yl-6-phenyl-1,3,5-triazin-2-yl)phenyl]naphthalen-1-yl]-6-(4-isocyanophenyl)naphtho[2,1-f]quinoline;12-[3-[3-(4-dibenzofuran-3-yl-6-phenyl-1,3,5-triazin-2-yl)phenyl]phenyl]-6-(4-isocyanophenyl)naphtho[2,1-f]quinoline?

The canonical SMILES for 12-[3-(4-dibenzofuran-3-yl-6-phenyl-1,3,5-triazin-2-yl)phenyl]-6-(6-isocyanonaphthalen-2-yl)naphtho[2,1-f]quinoline;12-[4-[3-(4-dibenzofuran-2-yl-6-phenyl-1,3,5-triazin-2-yl)phenyl]naphthalen-1-yl]-6-(4-isocyanophenyl)naphtho[2,1-f]quinoline;12-[4-[3-(4-dibenzofuran-3-yl-6-phenyl-1,3,5-triazin-2-yl)phenyl]naphthalen-1-yl]-6-(4-isocyanophenyl)naphtho[2,1-f]quinoline;12-[3-[3-(4-dibenzofuran-3-yl-6-phenyl-1,3,5-triazin-2-yl)phenyl]phenyl]-6-(4-isocyanophenyl)naphtho[2,1-f]quinoline is [C-]#[N+]c1ccc(-c2cc3c4cccnc4c(-c4ccc(-c5cccc(-c6nc(-c7ccccc7)nc(-c7ccc8c(c7)oc7ccccc78)n6)c5)c5ccccc45)cc3c3ccccc23)cc1.[C-]#[N+]c1ccc(-c2cc3c4cccnc4c(-c4ccc(-c5cccc(-c6nc(-c7ccccc7)nc(-c7ccc8oc9ccccc9c8c7)n6)c5)c5ccccc45)cc3c3ccccc23)cc1.[C-]#[N+]c1ccc(-c2cc3c4cccnc4c(-c4cccc(-c5cccc(-c6nc(-c7ccccc7)nc(-c7ccc8c(c7)oc7ccccc78)n6)c5)c4)cc3c3ccccc23)cc1.[C-]#[N+]c1ccc2cc(-c3cc4c5cccnc5c(-c5cccc(-c6nc(-c7ccccc7)nc(-c7ccc8c(c7)oc7ccccc78)n6)c5)cc4c4ccccc34)ccc2c1.

What is the InChIKey of 12-[3-(4-dibenzofuran-3-yl-6-phenyl-1,3,5-triazin-2-yl)phenyl]-6-(6-isocyanonaphthalen-2-yl)naphtho[2,1-f]quinoline;12-[4-[3-(4-dibenzofuran-2-yl-6-phenyl-1,3,5-triazin-2-yl)phenyl]naphthalen-1-yl]-6-(4-isocyanophenyl)naphtho[2,1-f]quinoline;12-[4-[3-(4-dibenzofuran-3-yl-6-phenyl-1,3,5-triazin-2-yl)phenyl]naphthalen-1-yl]-6-(4-isocyanophenyl)naphtho[2,1-f]quinoline;12-[3-[3-(4-dibenzofuran-3-yl-6-phenyl-1,3,5-triazin-2-yl)phenyl]phenyl]-6-(4-isocyanophenyl)naphtho[2,1-f]quinoline?

The InChIKey is KVTCMIPMTNWPSY-UHFFFAOYSA-N. The full InChI is InChI=1S/2C61H35N5O.C57H33N5O.C55H31N5O/c1-62-42-27-24-37(25-28-42)51-35-53-50-22-12-32-63-58(50)55(36-52(53)47-20-8-7-19-46(47)51)48-30-29-43(44-17-5-6-18-45(44)48)39-15-11-16-40(33-39)60-64-59(38-13-3-2-4-14-38)65-61(66-60)41-26-31-57-54(34-41)49-21-9-10-23-56(49)67-57;1-62-42-27-24-37(25-28-42)52-35-54-51-22-12-32-63-58(51)55(36-53(54)47-20-8-7-19-46(47)52)48-31-30-43(44-17-5-6-18-45(44)48)39-15-11-16-40(33-39)60-64-59(38-13-3-2-4-14-38)65-61(66-60)41-26-29-50-49-21-9-10-23-56(49)67-57(50)34-41;1-58-42-26-23-35(24-27-42)48-33-51-47-21-11-29-59-54(47)49(34-50(51)44-19-6-5-18-43(44)48)39-16-9-14-37(30-39)38-15-10-17-40(31-38)56-60-55(36-12-3-2-4-13-36)61-57(62-56)41-25-28-46-45-20-7-8-22-52(45)63-53(46)32-41;1-56-40-24-22-34-27-37(21-20-35(34)29-40)46-31-49-45-18-10-26-57-52(45)47(32-48(49)42-16-6-5-15-41(42)46)36-13-9-14-38(28-36)54-58-53(33-11-3-2-4-12-33)59-55(60-54)39-23-25-44-43-17-7-8-19-50(43)61-51(44)30-39/h2*2-36H;2-34H;2-32H.

What are the key properties of 12-[3-(4-dibenzofuran-3-yl-6-phenyl-1,3,5-triazin-2-yl)phenyl]-6-(6-isocyanonaphthalen-2-yl)naphtho[2,1-f]quinoline;12-[4-[3-(4-dibenzofuran-2-yl-6-phenyl-1,3,5-triazin-2-yl)phenyl]naphthalen-1-yl]-6-(4-isocyanophenyl)naphtho[2,1-f]quinoline;12-[4-[3-(4-dibenzofuran-3-yl-6-phenyl-1,3,5-triazin-2-yl)phenyl]naphthalen-1-yl]-6-(4-isocyanophenyl)naphtho[2,1-f]quinoline;12-[3-[3-(4-dibenzofuran-3-yl-6-phenyl-1,3,5-triazin-2-yl)phenyl]phenyl]-6-(4-isocyanophenyl)naphtho[2,1-f]quinoline?

12-[3-(4-dibenzofuran-3-yl-6-phenyl-1,3,5-triazin-2-yl)phenyl]-6-(6-isocyanonaphthalen-2-yl)naphtho[2,1-f]quinoline;12-[4-[3-(4-dibenzofuran-2-yl-6-phenyl-1,3,5-triazin-2-yl)phenyl]naphthalen-1-yl]-6-(4-isocyanophenyl)naphtho[2,1-f]quinoline;12-[4-[3-(4-dibenzofuran-3-yl-6-phenyl-1,3,5-triazin-2-yl)phenyl]naphthalen-1-yl]-6-(4-isocyanophenyl)naphtho[2,1-f]quinoline;12-[3-[3-(4-dibenzofuran-3-yl-6-phenyl-1,3,5-triazin-2-yl)phenyl]phenyl]-6-(4-isocyanophenyl)naphtho[2,1-f]quinoline has a molecular weight of 3289.78 g/mol, XLogP of 62.51, 23 rotatable bonds, 0 hydrogen bond donors, and 20 hydrogen bond acceptors.

Where does this data come from?

All data for 12-[3-(4-dibenzofuran-3-yl-6-phenyl-1,3,5-triazin-2-yl)phenyl]-6-(6-isocyanonaphthalen-2-yl)naphtho[2,1-f]quinoline;12-[4-[3-(4-dibenzofuran-2-yl-6-phenyl-1,3,5-triazin-2-yl)phenyl]naphthalen-1-yl]-6-(4-isocyanophenyl)naphtho[2,1-f]quinoline;12-[4-[3-(4-dibenzofuran-3-yl-6-phenyl-1,3,5-triazin-2-yl)phenyl]naphthalen-1-yl]-6-(4-isocyanophenyl)naphtho[2,1-f]quinoline;12-[3-[3-(4-dibenzofuran-3-yl-6-phenyl-1,3,5-triazin-2-yl)phenyl]phenyl]-6-(4-isocyanophenyl)naphtho[2,1-f]quinoline is sourced from PubChem (CID 165018862), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).