2-[4-(2,6-diphenylpyrimidin-4-yl)phenyl]-4-phenyl-1-triphenylen-2-ylfuro[2,3-c]quinoline;2-[3-[3-(4,6-diphenyl-1,3,5-triazin-2-yl)phenyl]phenyl]-4-phenyl-1-triphenylen-2-ylfuro[2,3-c]quinoline;2-[4-[4-(4,6-diphenyl-1,3,5-triazin-2-yl)phenyl]phenyl]-4-phenyl-1-triphenylen-2-ylfuro[2,3-c]quinoline

C181H111N11O3 — CID 165077999

About 2-[4-(2,6-diphenylpyrimidin-4-yl)phenyl]-4-phenyl-1-triphenylen-2-ylfuro[2,3-c]quinoline;2-[3-[3-(4,6-diphenyl-1,3,5-triazin-2-yl)phenyl]phenyl]-4-phenyl-1-triphenylen-2-ylfuro[2,3-c]quinoline;2-[4-[4-(4,6-diphenyl-1,3,5-triazin-2-yl)phenyl]phenyl]-4-phenyl-1-triphenylen-2-ylfuro[2,3-c]quinoline

2-[4-(2,6-diphenylpyrimidin-4-yl)phenyl]-4-phenyl-1-triphenylen-2-ylfuro[2,3-c]quinoline;2-[3-[3-(4,6-diphenyl-1,3,5-triazin-2-yl)phenyl]phenyl]-4-phenyl-1-triphenylen-2-ylfuro[2,3-c]quinoline;2-[4-[4-(4,6-diphenyl-1,3,5-triazin-2-yl)phenyl]phenyl]-4-phenyl-1-triphenylen-2-ylfuro[2,3-c]quinoline (PubChem CID 165077999) has the molecular formula C181H111N11O3 and a molecular weight of 2487.95 g/mol. Its IUPAC name is 2-[4-(2,6-diphenylpyrimidin-4-yl)phenyl]-4-phenyl-1-triphenylen-2-ylfuro[2,3-c]quinoline;2-[3-[3-(4,6-diphenyl-1,3,5-triazin-2-yl)phenyl]phenyl]-4-phenyl-1-triphenylen-2-ylfuro[2,3-c]quinoline;2-[4-[4-(4,6-diphenyl-1,3,5-triazin-2-yl)phenyl]phenyl]-4-phenyl-1-triphenylen-2-ylfuro[2,3-c]quinoline.

Molecular Properties

• Compound Name: 2-[4-(2,6-diphenylpyrimidin-4-yl)phenyl]-4-phenyl-1-triphenylen-2-ylfuro[2,3-c]quinoline;2-[3-[3-(4,6-diphenyl-1,3,5-triazin-2-yl)phenyl]phenyl]-4-phenyl-1-triphenylen-2-ylfuro[2,3-c]quinoline;2-[4-[4-(4,6-diphenyl-1,3,5-triazin-2-yl)phenyl]phenyl]-4-phenyl-1-triphenylen-2-ylfuro[2,3-c]quinoline
• PubChem CID: 165077999
• Molecular Formula: C181H111N11O3
• Molecular Weight: 2487.95 g/mol
• Exact Mass: 2485.89
• IUPAC Name: 2-[4-(2,6-diphenylpyrimidin-4-yl)phenyl]-4-phenyl-1-triphenylen-2-ylfuro[2,3-c]quinoline;2-[3-[3-(4,6-diphenyl-1,3,5-triazin-2-yl)phenyl]phenyl]-4-phenyl-1-triphenylen-2-ylfuro[2,3-c]quinoline;2-[4-[4-(4,6-diphenyl-1,3,5-triazin-2-yl)phenyl]phenyl]-4-phenyl-1-triphenylen-2-ylfuro[2,3-c]quinoline
• SMILES: c1ccc(-c2cc(-c3ccc(-c4oc5c(-c6ccccc6)nc6ccccc6c5c4-c4ccc5c6ccccc6c6ccccc6c5c4)cc3)nc(-c3ccccc3)n2)cc1.c1ccc(-c2nc(-c3ccccc3)nc(-c3ccc(-c4ccc(-c5oc6c(-c7ccccc7)nc7ccccc7c6c5-c5ccc6c7ccccc7c7ccccc7c6c5)cc4)cc3)n2)cc1.c1ccc(-c2nc(-c3ccccc3)nc(-c3cccc(-c4cccc(-c5oc6c(-c7ccccc7)nc7ccccc7c6c5-c5ccc6c7ccccc7c7ccccc7c6c5)c4)c3)n2)cc1
• InChI: InChI=1S/2C62H38N4O.C57H35N3O/c1-4-18-39(19-5-1)57-59-56(52-32-14-15-33-54(52)63-57)55(44-34-35-51-49-30-11-10-28-47(49)48-29-12-13-31-50(48)53(51)38-44)58(67-59)45-26-16-24-42(36-45)43-25-17-27-46(37-43)62-65-60(40-20-6-2-7-21-40)64-61(66-62)41-22-8-3-9-23-41;1-4-16-41(17-5-1)57-59-56(52-26-14-15-27-54(52)63-57)55(46-36-37-51-49-24-11-10-22-47(49)48-23-12-13-25-50(48)53(51)38-46)58(67-59)42-32-28-39(29-33-42)40-30-34-45(35-31-40)62-65-60(43-18-6-2-7-19-43)64-61(66-62)44-20-8-3-9-21-44;1-4-16-36(17-5-1)50-35-51(60-57(59-50)40-20-8-3-9-21-40)37-28-30-39(31-29-37)55-52(53-47-26-14-15-27-49(47)58-54(56(53)61-55)38-18-6-2-7-19-38)41-32-33-46-44-24-11-10-22-42(44)43-23-12-13-25-45(43)48(46)34-41/h2*1-38H;1-35H
• InChIKey: UQHISJIMMPGDBE-UHFFFAOYSA-N
• XLogP: 47.82
• TPSA: 181.21 Ų
• H-Bond Acceptors: 14
• Rotatable Bonds: 20
• Heavy Atoms: 195
• Complexity: —

Lipinski Rule of Five

3 violations

Rule	Value
MW ≤ 500	2487.95
LogP ≤ 5	47.82
H-Bond Donors ≤ 5	0
H-Bond Acceptors ≤ 10	14

Computed Properties (RDKit)

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

Frequently Asked Questions

What is the IUPAC name of 2-[4-(2,6-diphenylpyrimidin-4-yl)phenyl]-4-phenyl-1-triphenylen-2-ylfuro[2,3-c]quinoline;2-[3-[3-(4,6-diphenyl-1,3,5-triazin-2-yl)phenyl]phenyl]-4-phenyl-1-triphenylen-2-ylfuro[2,3-c]quinoline;2-[4-[4-(4,6-diphenyl-1,3,5-triazin-2-yl)phenyl]phenyl]-4-phenyl-1-triphenylen-2-ylfuro[2,3-c]quinoline?

The IUPAC name of 2-[4-(2,6-diphenylpyrimidin-4-yl)phenyl]-4-phenyl-1-triphenylen-2-ylfuro[2,3-c]quinoline;2-[3-[3-(4,6-diphenyl-1,3,5-triazin-2-yl)phenyl]phenyl]-4-phenyl-1-triphenylen-2-ylfuro[2,3-c]quinoline;2-[4-[4-(4,6-diphenyl-1,3,5-triazin-2-yl)phenyl]phenyl]-4-phenyl-1-triphenylen-2-ylfuro[2,3-c]quinoline (CID 165077999) is 2-[4-(2,6-diphenylpyrimidin-4-yl)phenyl]-4-phenyl-1-triphenylen-2-ylfuro[2,3-c]quinoline;2-[3-[3-(4,6-diphenyl-1,3,5-triazin-2-yl)phenyl]phenyl]-4-phenyl-1-triphenylen-2-ylfuro[2,3-c]quinoline;2-[4-[4-(4,6-diphenyl-1,3,5-triazin-2-yl)phenyl]phenyl]-4-phenyl-1-triphenylen-2-ylfuro[2,3-c]quinoline.

What is the SMILES notation for 2-[4-(2,6-diphenylpyrimidin-4-yl)phenyl]-4-phenyl-1-triphenylen-2-ylfuro[2,3-c]quinoline;2-[3-[3-(4,6-diphenyl-1,3,5-triazin-2-yl)phenyl]phenyl]-4-phenyl-1-triphenylen-2-ylfuro[2,3-c]quinoline;2-[4-[4-(4,6-diphenyl-1,3,5-triazin-2-yl)phenyl]phenyl]-4-phenyl-1-triphenylen-2-ylfuro[2,3-c]quinoline?

The canonical SMILES for 2-[4-(2,6-diphenylpyrimidin-4-yl)phenyl]-4-phenyl-1-triphenylen-2-ylfuro[2,3-c]quinoline;2-[3-[3-(4,6-diphenyl-1,3,5-triazin-2-yl)phenyl]phenyl]-4-phenyl-1-triphenylen-2-ylfuro[2,3-c]quinoline;2-[4-[4-(4,6-diphenyl-1,3,5-triazin-2-yl)phenyl]phenyl]-4-phenyl-1-triphenylen-2-ylfuro[2,3-c]quinoline is c1ccc(-c2cc(-c3ccc(-c4oc5c(-c6ccccc6)nc6ccccc6c5c4-c4ccc5c6ccccc6c6ccccc6c5c4)cc3)nc(-c3ccccc3)n2)cc1.c1ccc(-c2nc(-c3ccccc3)nc(-c3ccc(-c4ccc(-c5oc6c(-c7ccccc7)nc7ccccc7c6c5-c5ccc6c7ccccc7c7ccccc7c6c5)cc4)cc3)n2)cc1.c1ccc(-c2nc(-c3ccccc3)nc(-c3cccc(-c4cccc(-c5oc6c(-c7ccccc7)nc7ccccc7c6c5-c5ccc6c7ccccc7c7ccccc7c6c5)c4)c3)n2)cc1.

What is the InChIKey of 2-[4-(2,6-diphenylpyrimidin-4-yl)phenyl]-4-phenyl-1-triphenylen-2-ylfuro[2,3-c]quinoline;2-[3-[3-(4,6-diphenyl-1,3,5-triazin-2-yl)phenyl]phenyl]-4-phenyl-1-triphenylen-2-ylfuro[2,3-c]quinoline;2-[4-[4-(4,6-diphenyl-1,3,5-triazin-2-yl)phenyl]phenyl]-4-phenyl-1-triphenylen-2-ylfuro[2,3-c]quinoline?

The InChIKey is UQHISJIMMPGDBE-UHFFFAOYSA-N. The full InChI is InChI=1S/2C62H38N4O.C57H35N3O/c1-4-18-39(19-5-1)57-59-56(52-32-14-15-33-54(52)63-57)55(44-34-35-51-49-30-11-10-28-47(49)48-29-12-13-31-50(48)53(51)38-44)58(67-59)45-26-16-24-42(36-45)43-25-17-27-46(37-43)62-65-60(40-20-6-2-7-21-40)64-61(66-62)41-22-8-3-9-23-41;1-4-16-41(17-5-1)57-59-56(52-26-14-15-27-54(52)63-57)55(46-36-37-51-49-24-11-10-22-47(49)48-23-12-13-25-50(48)53(51)38-46)58(67-59)42-32-28-39(29-33-42)40-30-34-45(35-31-40)62-65-60(43-18-6-2-7-19-43)64-61(66-62)44-20-8-3-9-21-44;1-4-16-36(17-5-1)50-35-51(60-57(59-50)40-20-8-3-9-21-40)37-28-30-39(31-29-37)55-52(53-47-26-14-15-27-49(47)58-54(56(53)61-55)38-18-6-2-7-19-38)41-32-33-46-44-24-11-10-22-42(44)43-23-12-13-25-45(43)48(46)34-41/h2*1-38H;1-35H.

What are the key properties of 2-[4-(2,6-diphenylpyrimidin-4-yl)phenyl]-4-phenyl-1-triphenylen-2-ylfuro[2,3-c]quinoline;2-[3-[3-(4,6-diphenyl-1,3,5-triazin-2-yl)phenyl]phenyl]-4-phenyl-1-triphenylen-2-ylfuro[2,3-c]quinoline;2-[4-[4-(4,6-diphenyl-1,3,5-triazin-2-yl)phenyl]phenyl]-4-phenyl-1-triphenylen-2-ylfuro[2,3-c]quinoline?

2-[4-(2,6-diphenylpyrimidin-4-yl)phenyl]-4-phenyl-1-triphenylen-2-ylfuro[2,3-c]quinoline;2-[3-[3-(4,6-diphenyl-1,3,5-triazin-2-yl)phenyl]phenyl]-4-phenyl-1-triphenylen-2-ylfuro[2,3-c]quinoline;2-[4-[4-(4,6-diphenyl-1,3,5-triazin-2-yl)phenyl]phenyl]-4-phenyl-1-triphenylen-2-ylfuro[2,3-c]quinoline has a molecular weight of 2487.95 g/mol, XLogP of 47.82, 20 rotatable bonds, 0 hydrogen bond donors, and 14 hydrogen bond acceptors.

Where does this data come from?

All data for 2-[4-(2,6-diphenylpyrimidin-4-yl)phenyl]-4-phenyl-1-triphenylen-2-ylfuro[2,3-c]quinoline;2-[3-[3-(4,6-diphenyl-1,3,5-triazin-2-yl)phenyl]phenyl]-4-phenyl-1-triphenylen-2-ylfuro[2,3-c]quinoline;2-[4-[4-(4,6-diphenyl-1,3,5-triazin-2-yl)phenyl]phenyl]-4-phenyl-1-triphenylen-2-ylfuro[2,3-c]quinoline is sourced from PubChem (CID 165077999), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).