2-(12-dibenzofuran-2-yltriphenylen-2-yl)-4,6-diphenylpyridine;3-[11-(4,6-diphenyl-2-pyridinyl)triphenylen-1-yl]-9-phenylcarbazole;2-[11-(4,6-diphenyl-1,3,5-triazin-2-yl)triphenylen-1-yl]-9-phenylcarbazole

C151H95N7O — CID 159916327

About 2-(12-dibenzofuran-2-yltriphenylen-2-yl)-4,6-diphenylpyridine;3-[11-(4,6-diphenyl-2-pyridinyl)triphenylen-1-yl]-9-phenylcarbazole;2-[11-(4,6-diphenyl-1,3,5-triazin-2-yl)triphenylen-1-yl]-9-phenylcarbazole

2-(12-dibenzofuran-2-yltriphenylen-2-yl)-4,6-diphenylpyridine;3-[11-(4,6-diphenyl-2-pyridinyl)triphenylen-1-yl]-9-phenylcarbazole;2-[11-(4,6-diphenyl-1,3,5-triazin-2-yl)triphenylen-1-yl]-9-phenylcarbazole (PubChem CID 159916327) has the molecular formula C151H95N7O and a molecular weight of 2023.47 g/mol. Its IUPAC name is 2-(12-dibenzofuran-2-yltriphenylen-2-yl)-4,6-diphenylpyridine;3-[11-(4,6-diphenyl-2-pyridinyl)triphenylen-1-yl]-9-phenylcarbazole;2-[11-(4,6-diphenyl-1,3,5-triazin-2-yl)triphenylen-1-yl]-9-phenylcarbazole.

Molecular Properties

• Compound Name: 2-(12-dibenzofuran-2-yltriphenylen-2-yl)-4,6-diphenylpyridine;3-[11-(4,6-diphenyl-2-pyridinyl)triphenylen-1-yl]-9-phenylcarbazole;2-[11-(4,6-diphenyl-1,3,5-triazin-2-yl)triphenylen-1-yl]-9-phenylcarbazole
• PubChem CID: 159916327
• Molecular Formula: C151H95N7O
• Molecular Weight: 2023.47 g/mol
• Exact Mass: 2021.76
• IUPAC Name: 2-(12-dibenzofuran-2-yltriphenylen-2-yl)-4,6-diphenylpyridine;3-[11-(4,6-diphenyl-2-pyridinyl)triphenylen-1-yl]-9-phenylcarbazole;2-[11-(4,6-diphenyl-1,3,5-triazin-2-yl)triphenylen-1-yl]-9-phenylcarbazole
• SMILES: c1ccc(-c2cc(-c3ccccc3)nc(-c3ccc4c5ccccc5c5cccc(-c6ccc7c(c6)c6ccccc6n7-c6ccccc6)c5c4c3)c2)cc1.c1ccc(-c2cc(-c3ccccc3)nc(-c3ccc4c5ccccc5c5cccc(-c6ccc7oc8ccccc8c7c6)c5c4c3)c2)cc1.c1ccc(-c2nc(-c3ccccc3)nc(-c3ccc4c5ccccc5c5cccc(-c6ccc7c8ccccc8n(-c8ccccc8)c7c6)c5c4c3)n2)cc1
• InChI: InChI=1S/C53H34N2.C51H32N4.C47H29NO/c1-4-15-35(16-5-1)39-33-49(36-17-6-2-7-18-36)54-50(34-39)38-27-29-44-42-21-10-11-22-43(42)46-25-14-24-41(53(46)48(44)32-38)37-28-30-52-47(31-37)45-23-12-13-26-51(45)55(52)40-19-8-3-9-20-40;1-4-15-33(16-5-1)49-52-50(34-17-6-2-7-18-34)54-51(53-49)36-28-29-41-39-21-10-11-22-40(39)44-25-14-24-38(48(44)45(41)31-36)35-27-30-43-42-23-12-13-26-46(42)55(47(43)32-35)37-19-8-3-9-20-37;1-3-12-30(13-4-1)34-28-43(31-14-5-2-6-15-31)48-44(29-34)33-22-24-38-36-16-7-8-17-37(36)40-20-11-19-35(47(40)42(38)27-33)32-23-25-46-41(26-32)39-18-9-10-21-45(39)49-46/h1-34H;1-32H;1-29H
• InChIKey: NXVCYOVSLWJSAQ-UHFFFAOYSA-N
• XLogP: 40.51
• TPSA: 87.45 Ų
• H-Bond Acceptors: 8
• Rotatable Bonds: 14
• Heavy Atoms: 159
• Complexity: —

Lipinski Rule of Five

2 violations

Rule	Value
MW ≤ 500	2023.47
LogP ≤ 5	40.51
H-Bond Donors ≤ 5	0
H-Bond Acceptors ≤ 10	8

Computed Properties (RDKit)

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

Frequently Asked Questions

What is the IUPAC name of 2-(12-dibenzofuran-2-yltriphenylen-2-yl)-4,6-diphenylpyridine;3-[11-(4,6-diphenyl-2-pyridinyl)triphenylen-1-yl]-9-phenylcarbazole;2-[11-(4,6-diphenyl-1,3,5-triazin-2-yl)triphenylen-1-yl]-9-phenylcarbazole?

The IUPAC name of 2-(12-dibenzofuran-2-yltriphenylen-2-yl)-4,6-diphenylpyridine;3-[11-(4,6-diphenyl-2-pyridinyl)triphenylen-1-yl]-9-phenylcarbazole;2-[11-(4,6-diphenyl-1,3,5-triazin-2-yl)triphenylen-1-yl]-9-phenylcarbazole (CID 159916327) is 2-(12-dibenzofuran-2-yltriphenylen-2-yl)-4,6-diphenylpyridine;3-[11-(4,6-diphenyl-2-pyridinyl)triphenylen-1-yl]-9-phenylcarbazole;2-[11-(4,6-diphenyl-1,3,5-triazin-2-yl)triphenylen-1-yl]-9-phenylcarbazole.

What is the SMILES notation for 2-(12-dibenzofuran-2-yltriphenylen-2-yl)-4,6-diphenylpyridine;3-[11-(4,6-diphenyl-2-pyridinyl)triphenylen-1-yl]-9-phenylcarbazole;2-[11-(4,6-diphenyl-1,3,5-triazin-2-yl)triphenylen-1-yl]-9-phenylcarbazole?

The canonical SMILES for 2-(12-dibenzofuran-2-yltriphenylen-2-yl)-4,6-diphenylpyridine;3-[11-(4,6-diphenyl-2-pyridinyl)triphenylen-1-yl]-9-phenylcarbazole;2-[11-(4,6-diphenyl-1,3,5-triazin-2-yl)triphenylen-1-yl]-9-phenylcarbazole is c1ccc(-c2cc(-c3ccccc3)nc(-c3ccc4c5ccccc5c5cccc(-c6ccc7c(c6)c6ccccc6n7-c6ccccc6)c5c4c3)c2)cc1.c1ccc(-c2cc(-c3ccccc3)nc(-c3ccc4c5ccccc5c5cccc(-c6ccc7oc8ccccc8c7c6)c5c4c3)c2)cc1.c1ccc(-c2nc(-c3ccccc3)nc(-c3ccc4c5ccccc5c5cccc(-c6ccc7c8ccccc8n(-c8ccccc8)c7c6)c5c4c3)n2)cc1.

What is the InChIKey of 2-(12-dibenzofuran-2-yltriphenylen-2-yl)-4,6-diphenylpyridine;3-[11-(4,6-diphenyl-2-pyridinyl)triphenylen-1-yl]-9-phenylcarbazole;2-[11-(4,6-diphenyl-1,3,5-triazin-2-yl)triphenylen-1-yl]-9-phenylcarbazole?

The InChIKey is NXVCYOVSLWJSAQ-UHFFFAOYSA-N. The full InChI is InChI=1S/C53H34N2.C51H32N4.C47H29NO/c1-4-15-35(16-5-1)39-33-49(36-17-6-2-7-18-36)54-50(34-39)38-27-29-44-42-21-10-11-22-43(42)46-25-14-24-41(53(46)48(44)32-38)37-28-30-52-47(31-37)45-23-12-13-26-51(45)55(52)40-19-8-3-9-20-40;1-4-15-33(16-5-1)49-52-50(34-17-6-2-7-18-34)54-51(53-49)36-28-29-41-39-21-10-11-22-40(39)44-25-14-24-38(48(44)45(41)31-36)35-27-30-43-42-23-12-13-26-46(42)55(47(43)32-35)37-19-8-3-9-20-37;1-3-12-30(13-4-1)34-28-43(31-14-5-2-6-15-31)48-44(29-34)33-22-24-38-36-16-7-8-17-37(36)40-20-11-19-35(47(40)42(38)27-33)32-23-25-46-41(26-32)39-18-9-10-21-45(39)49-46/h1-34H;1-32H;1-29H.

What are the key properties of 2-(12-dibenzofuran-2-yltriphenylen-2-yl)-4,6-diphenylpyridine;3-[11-(4,6-diphenyl-2-pyridinyl)triphenylen-1-yl]-9-phenylcarbazole;2-[11-(4,6-diphenyl-1,3,5-triazin-2-yl)triphenylen-1-yl]-9-phenylcarbazole?

2-(12-dibenzofuran-2-yltriphenylen-2-yl)-4,6-diphenylpyridine;3-[11-(4,6-diphenyl-2-pyridinyl)triphenylen-1-yl]-9-phenylcarbazole;2-[11-(4,6-diphenyl-1,3,5-triazin-2-yl)triphenylen-1-yl]-9-phenylcarbazole has a molecular weight of 2023.47 g/mol, XLogP of 40.51, 14 rotatable bonds, 0 hydrogen bond donors, and 8 hydrogen bond acceptors.

Where does this data come from?

All data for 2-(12-dibenzofuran-2-yltriphenylen-2-yl)-4,6-diphenylpyridine;3-[11-(4,6-diphenyl-2-pyridinyl)triphenylen-1-yl]-9-phenylcarbazole;2-[11-(4,6-diphenyl-1,3,5-triazin-2-yl)triphenylen-1-yl]-9-phenylcarbazole is sourced from PubChem (CID 159916327), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).