2-dibenzofuran-1-yl-4-[2-(8-phenanthren-2-yldibenzofuran-1-yl)phenyl]-6-phenyl-1,3,5-triazine;2-dibenzofuran-1-yl-4-[3-(8-phenanthren-2-yldibenzofuran-1-yl)phenyl]-6-phenyl-1,3,5-triazine;2-dibenzofuran-4-yl-4-[2-[8-(4-phenanthren-2-ylphenyl)dibenzofuran-1-yl]phenyl]-6-phenyl-1,3,5-triazine

C165H97N9O6 — CID 160563404

About 2-dibenzofuran-1-yl-4-[2-(8-phenanthren-2-yldibenzofuran-1-yl)phenyl]-6-phenyl-1,3,5-triazine;2-dibenzofuran-1-yl-4-[3-(8-phenanthren-2-yldibenzofuran-1-yl)phenyl]-6-phenyl-1,3,5-triazine;2-dibenzofuran-4-yl-4-[2-[8-(4-phenanthren-2-ylphenyl)dibenzofuran-1-yl]phenyl]-6-phenyl-1,3,5-triazine

2-dibenzofuran-1-yl-4-[2-(8-phenanthren-2-yldibenzofuran-1-yl)phenyl]-6-phenyl-1,3,5-triazine;2-dibenzofuran-1-yl-4-[3-(8-phenanthren-2-yldibenzofuran-1-yl)phenyl]-6-phenyl-1,3,5-triazine;2-dibenzofuran-4-yl-4-[2-[8-(4-phenanthren-2-ylphenyl)dibenzofuran-1-yl]phenyl]-6-phenyl-1,3,5-triazine (PubChem CID 160563404) has the molecular formula C165H97N9O6 and a molecular weight of 2301.65 g/mol. Its IUPAC name is 2-dibenzofuran-1-yl-4-[2-(8-phenanthren-2-yldibenzofuran-1-yl)phenyl]-6-phenyl-1,3,5-triazine;2-dibenzofuran-1-yl-4-[3-(8-phenanthren-2-yldibenzofuran-1-yl)phenyl]-6-phenyl-1,3,5-triazine;2-dibenzofuran-4-yl-4-[2-[8-(4-phenanthren-2-ylphenyl)dibenzofuran-1-yl]phenyl]-6-phenyl-1,3,5-triazine.

Molecular Properties

• Compound Name: 2-dibenzofuran-1-yl-4-[2-(8-phenanthren-2-yldibenzofuran-1-yl)phenyl]-6-phenyl-1,3,5-triazine;2-dibenzofuran-1-yl-4-[3-(8-phenanthren-2-yldibenzofuran-1-yl)phenyl]-6-phenyl-1,3,5-triazine;2-dibenzofuran-4-yl-4-[2-[8-(4-phenanthren-2-ylphenyl)dibenzofuran-1-yl]phenyl]-6-phenyl-1,3,5-triazine
• PubChem CID: 160563404
• Molecular Formula: C165H97N9O6
• Molecular Weight: 2301.65 g/mol
• Exact Mass: 2299.76
• IUPAC Name: 2-dibenzofuran-1-yl-4-[2-(8-phenanthren-2-yldibenzofuran-1-yl)phenyl]-6-phenyl-1,3,5-triazine;2-dibenzofuran-1-yl-4-[3-(8-phenanthren-2-yldibenzofuran-1-yl)phenyl]-6-phenyl-1,3,5-triazine;2-dibenzofuran-4-yl-4-[2-[8-(4-phenanthren-2-ylphenyl)dibenzofuran-1-yl]phenyl]-6-phenyl-1,3,5-triazine
• SMILES: c1ccc(-c2nc(-c3cccc(-c4cccc5oc6ccc(-c7ccc8c(ccc9ccccc98)c7)cc6c45)c3)nc(-c3cccc4oc5ccccc5c34)n2)cc1.c1ccc(-c2nc(-c3ccccc3-c3cccc4oc5ccc(-c6ccc(-c7ccc8c(ccc9ccccc98)c7)cc6)cc5c34)nc(-c3cccc4c3oc3ccccc34)n2)cc1.c1ccc(-c2nc(-c3ccccc3-c3cccc4oc5ccc(-c6ccc7c(ccc8ccccc87)c6)cc5c34)nc(-c3cccc4oc5ccccc5c34)n2)cc1
• InChI: InChI=1S/C59H35N3O2.2C53H31N3O2/c1-2-13-39(14-3-1)57-60-58(62-59(61-57)50-21-10-20-48-46-17-8-9-22-52(46)64-56(48)50)49-18-7-6-16-45(49)47-19-11-23-54-55(47)51-35-41(31-33-53(51)63-54)37-26-24-36(25-27-37)40-30-32-44-42(34-40)29-28-38-12-4-5-15-43(38)44;1-2-12-33(13-3-1)51-54-52(56-53(55-51)43-19-10-22-48-50(43)42-17-6-7-20-45(42)57-48)38-15-8-14-36(30-38)41-18-9-21-47-49(41)44-31-35(26-28-46(44)58-47)34-25-27-40-37(29-34)24-23-32-11-4-5-16-39(32)40;1-2-13-33(14-3-1)51-54-52(56-53(55-51)43-20-11-23-48-50(43)42-18-8-9-21-45(42)57-48)41-17-7-6-16-39(41)40-19-10-22-47-49(40)44-31-35(27-29-46(44)58-47)34-26-28-38-36(30-34)25-24-32-12-4-5-15-37(32)38/h1-35H;2*1-31H
• InChIKey: QZPMTKIOBFBZIA-UHFFFAOYSA-N
• XLogP: 44.60
• TPSA: 194.85 Ų
• H-Bond Acceptors: 15
• Rotatable Bonds: 16
• Heavy Atoms: 180
• Complexity: —

Lipinski Rule of Five

3 violations

Rule	Value
MW ≤ 500	2301.65
LogP ≤ 5	44.60
H-Bond Donors ≤ 5	0
H-Bond Acceptors ≤ 10	15

Computed Properties (RDKit)

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

Frequently Asked Questions

What is the IUPAC name of 2-dibenzofuran-1-yl-4-[2-(8-phenanthren-2-yldibenzofuran-1-yl)phenyl]-6-phenyl-1,3,5-triazine;2-dibenzofuran-1-yl-4-[3-(8-phenanthren-2-yldibenzofuran-1-yl)phenyl]-6-phenyl-1,3,5-triazine;2-dibenzofuran-4-yl-4-[2-[8-(4-phenanthren-2-ylphenyl)dibenzofuran-1-yl]phenyl]-6-phenyl-1,3,5-triazine?

The IUPAC name of 2-dibenzofuran-1-yl-4-[2-(8-phenanthren-2-yldibenzofuran-1-yl)phenyl]-6-phenyl-1,3,5-triazine;2-dibenzofuran-1-yl-4-[3-(8-phenanthren-2-yldibenzofuran-1-yl)phenyl]-6-phenyl-1,3,5-triazine;2-dibenzofuran-4-yl-4-[2-[8-(4-phenanthren-2-ylphenyl)dibenzofuran-1-yl]phenyl]-6-phenyl-1,3,5-triazine (CID 160563404) is 2-dibenzofuran-1-yl-4-[2-(8-phenanthren-2-yldibenzofuran-1-yl)phenyl]-6-phenyl-1,3,5-triazine;2-dibenzofuran-1-yl-4-[3-(8-phenanthren-2-yldibenzofuran-1-yl)phenyl]-6-phenyl-1,3,5-triazine;2-dibenzofuran-4-yl-4-[2-[8-(4-phenanthren-2-ylphenyl)dibenzofuran-1-yl]phenyl]-6-phenyl-1,3,5-triazine.

What is the SMILES notation for 2-dibenzofuran-1-yl-4-[2-(8-phenanthren-2-yldibenzofuran-1-yl)phenyl]-6-phenyl-1,3,5-triazine;2-dibenzofuran-1-yl-4-[3-(8-phenanthren-2-yldibenzofuran-1-yl)phenyl]-6-phenyl-1,3,5-triazine;2-dibenzofuran-4-yl-4-[2-[8-(4-phenanthren-2-ylphenyl)dibenzofuran-1-yl]phenyl]-6-phenyl-1,3,5-triazine?

The canonical SMILES for 2-dibenzofuran-1-yl-4-[2-(8-phenanthren-2-yldibenzofuran-1-yl)phenyl]-6-phenyl-1,3,5-triazine;2-dibenzofuran-1-yl-4-[3-(8-phenanthren-2-yldibenzofuran-1-yl)phenyl]-6-phenyl-1,3,5-triazine;2-dibenzofuran-4-yl-4-[2-[8-(4-phenanthren-2-ylphenyl)dibenzofuran-1-yl]phenyl]-6-phenyl-1,3,5-triazine is c1ccc(-c2nc(-c3cccc(-c4cccc5oc6ccc(-c7ccc8c(ccc9ccccc98)c7)cc6c45)c3)nc(-c3cccc4oc5ccccc5c34)n2)cc1.c1ccc(-c2nc(-c3ccccc3-c3cccc4oc5ccc(-c6ccc(-c7ccc8c(ccc9ccccc98)c7)cc6)cc5c34)nc(-c3cccc4c3oc3ccccc34)n2)cc1.c1ccc(-c2nc(-c3ccccc3-c3cccc4oc5ccc(-c6ccc7c(ccc8ccccc87)c6)cc5c34)nc(-c3cccc4oc5ccccc5c34)n2)cc1.

What is the InChIKey of 2-dibenzofuran-1-yl-4-[2-(8-phenanthren-2-yldibenzofuran-1-yl)phenyl]-6-phenyl-1,3,5-triazine;2-dibenzofuran-1-yl-4-[3-(8-phenanthren-2-yldibenzofuran-1-yl)phenyl]-6-phenyl-1,3,5-triazine;2-dibenzofuran-4-yl-4-[2-[8-(4-phenanthren-2-ylphenyl)dibenzofuran-1-yl]phenyl]-6-phenyl-1,3,5-triazine?

The InChIKey is QZPMTKIOBFBZIA-UHFFFAOYSA-N. The full InChI is InChI=1S/C59H35N3O2.2C53H31N3O2/c1-2-13-39(14-3-1)57-60-58(62-59(61-57)50-21-10-20-48-46-17-8-9-22-52(46)64-56(48)50)49-18-7-6-16-45(49)47-19-11-23-54-55(47)51-35-41(31-33-53(51)63-54)37-26-24-36(25-27-37)40-30-32-44-42(34-40)29-28-38-12-4-5-15-43(38)44;1-2-12-33(13-3-1)51-54-52(56-53(55-51)43-19-10-22-48-50(43)42-17-6-7-20-45(42)57-48)38-15-8-14-36(30-38)41-18-9-21-47-49(41)44-31-35(26-28-46(44)58-47)34-25-27-40-37(29-34)24-23-32-11-4-5-16-39(32)40;1-2-13-33(14-3-1)51-54-52(56-53(55-51)43-20-11-23-48-50(43)42-18-8-9-21-45(42)57-48)41-17-7-6-16-39(41)40-19-10-22-47-49(40)44-31-35(27-29-46(44)58-47)34-26-28-38-36(30-34)25-24-32-12-4-5-15-37(32)38/h1-35H;2*1-31H.

What are the key properties of 2-dibenzofuran-1-yl-4-[2-(8-phenanthren-2-yldibenzofuran-1-yl)phenyl]-6-phenyl-1,3,5-triazine;2-dibenzofuran-1-yl-4-[3-(8-phenanthren-2-yldibenzofuran-1-yl)phenyl]-6-phenyl-1,3,5-triazine;2-dibenzofuran-4-yl-4-[2-[8-(4-phenanthren-2-ylphenyl)dibenzofuran-1-yl]phenyl]-6-phenyl-1,3,5-triazine?

2-dibenzofuran-1-yl-4-[2-(8-phenanthren-2-yldibenzofuran-1-yl)phenyl]-6-phenyl-1,3,5-triazine;2-dibenzofuran-1-yl-4-[3-(8-phenanthren-2-yldibenzofuran-1-yl)phenyl]-6-phenyl-1,3,5-triazine;2-dibenzofuran-4-yl-4-[2-[8-(4-phenanthren-2-ylphenyl)dibenzofuran-1-yl]phenyl]-6-phenyl-1,3,5-triazine has a molecular weight of 2301.65 g/mol, XLogP of 44.60, 16 rotatable bonds, 0 hydrogen bond donors, and 15 hydrogen bond acceptors.

Where does this data come from?

All data for 2-dibenzofuran-1-yl-4-[2-(8-phenanthren-2-yldibenzofuran-1-yl)phenyl]-6-phenyl-1,3,5-triazine;2-dibenzofuran-1-yl-4-[3-(8-phenanthren-2-yldibenzofuran-1-yl)phenyl]-6-phenyl-1,3,5-triazine;2-dibenzofuran-4-yl-4-[2-[8-(4-phenanthren-2-ylphenyl)dibenzofuran-1-yl]phenyl]-6-phenyl-1,3,5-triazine is sourced from PubChem (CID 160563404), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).