7-[3,5-di(quinolin-4-yl)phenyl]-2-[2-(3-pyridin-2-ylphenyl)quinolin-7-yl]quinoline;2-phenyl-9-[3-[2-[2-(3-phenylphenyl)quinolin-7-yl]quinolin-7-yl]phenyl]-1,10-phenanthroline

C107H67N9 — CID 165060350

About 7-[3,5-di(quinolin-4-yl)phenyl]-2-[2-(3-pyridin-2-ylphenyl)quinolin-7-yl]quinoline;2-phenyl-9-[3-[2-[2-(3-phenylphenyl)quinolin-7-yl]quinolin-7-yl]phenyl]-1,10-phenanthroline

7-[3,5-di(quinolin-4-yl)phenyl]-2-[2-(3-pyridin-2-ylphenyl)quinolin-7-yl]quinoline;2-phenyl-9-[3-[2-[2-(3-phenylphenyl)quinolin-7-yl]quinolin-7-yl]phenyl]-1,10-phenanthroline (PubChem CID 165060350) has the molecular formula C107H67N9 and a molecular weight of 1478.78 g/mol. Its IUPAC name is 7-[3,5-di(quinolin-4-yl)phenyl]-2-[2-(3-pyridin-2-ylphenyl)quinolin-7-yl]quinoline;2-phenyl-9-[3-[2-[2-(3-phenylphenyl)quinolin-7-yl]quinolin-7-yl]phenyl]-1,10-phenanthroline.

Molecular Properties

• Compound Name: 7-[3,5-di(quinolin-4-yl)phenyl]-2-[2-(3-pyridin-2-ylphenyl)quinolin-7-yl]quinoline;2-phenyl-9-[3-[2-[2-(3-phenylphenyl)quinolin-7-yl]quinolin-7-yl]phenyl]-1,10-phenanthroline
• PubChem CID: 165060350
• Molecular Formula: C107H67N9
• Molecular Weight: 1478.78 g/mol
• Exact Mass: 1477.55
• IUPAC Name: 7-[3,5-di(quinolin-4-yl)phenyl]-2-[2-(3-pyridin-2-ylphenyl)quinolin-7-yl]quinoline;2-phenyl-9-[3-[2-[2-(3-phenylphenyl)quinolin-7-yl]quinolin-7-yl]phenyl]-1,10-phenanthroline
• SMILES: c1ccc(-c2cccc(-c3ccc4ccc(-c5ccc6ccc(-c7cc(-c8ccnc9ccccc89)cc(-c8ccnc9ccccc89)c7)cc6n5)cc4n3)c2)nc1.c1ccc(-c2cccc(-c3ccc4ccc(-c5ccc6ccc(-c7cccc(-c8ccc9ccc%10ccc(-c%11ccccc%11)nc%10c9n8)c7)cc6n5)cc4n3)c2)cc1
• InChI: InChI=1S/C54H34N4.C53H33N5/c1-3-9-35(10-4-1)41-13-7-15-44(31-41)48-27-23-38-18-22-46(34-52(38)55-48)49-28-24-37-17-21-43(33-51(37)56-49)42-14-8-16-45(32-42)50-30-26-40-20-19-39-25-29-47(36-11-5-2-6-12-36)57-53(39)54(40)58-50;1-3-13-50-45(10-1)43(23-26-55-50)41-29-40(30-42(31-41)44-24-27-56-51-14-4-2-11-46(44)51)36-17-15-34-20-22-49(58-52(34)32-36)39-18-16-35-19-21-48(57-53(35)33-39)38-9-7-8-37(28-38)47-12-5-6-25-54-47/h1-34H;1-33H
• InChIKey: RCDIDWQTJRMKNQ-UHFFFAOYSA-N
• XLogP: 27.16
• TPSA: 116.01 Ų
• H-Bond Acceptors: 9
• Rotatable Bonds: 12
• Heavy Atoms: 116
• Complexity: —

Lipinski Rule of Five

2 violations

Rule	Value
MW ≤ 500	1478.78
LogP ≤ 5	27.16
H-Bond Donors ≤ 5	0
H-Bond Acceptors ≤ 10	9

Computed Properties (RDKit)

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

Frequently Asked Questions

What is the IUPAC name of 7-[3,5-di(quinolin-4-yl)phenyl]-2-[2-(3-pyridin-2-ylphenyl)quinolin-7-yl]quinoline;2-phenyl-9-[3-[2-[2-(3-phenylphenyl)quinolin-7-yl]quinolin-7-yl]phenyl]-1,10-phenanthroline?

The IUPAC name of 7-[3,5-di(quinolin-4-yl)phenyl]-2-[2-(3-pyridin-2-ylphenyl)quinolin-7-yl]quinoline;2-phenyl-9-[3-[2-[2-(3-phenylphenyl)quinolin-7-yl]quinolin-7-yl]phenyl]-1,10-phenanthroline (CID 165060350) is 7-[3,5-di(quinolin-4-yl)phenyl]-2-[2-(3-pyridin-2-ylphenyl)quinolin-7-yl]quinoline;2-phenyl-9-[3-[2-[2-(3-phenylphenyl)quinolin-7-yl]quinolin-7-yl]phenyl]-1,10-phenanthroline.

What is the SMILES notation for 7-[3,5-di(quinolin-4-yl)phenyl]-2-[2-(3-pyridin-2-ylphenyl)quinolin-7-yl]quinoline;2-phenyl-9-[3-[2-[2-(3-phenylphenyl)quinolin-7-yl]quinolin-7-yl]phenyl]-1,10-phenanthroline?

The canonical SMILES for 7-[3,5-di(quinolin-4-yl)phenyl]-2-[2-(3-pyridin-2-ylphenyl)quinolin-7-yl]quinoline;2-phenyl-9-[3-[2-[2-(3-phenylphenyl)quinolin-7-yl]quinolin-7-yl]phenyl]-1,10-phenanthroline is c1ccc(-c2cccc(-c3ccc4ccc(-c5ccc6ccc(-c7cc(-c8ccnc9ccccc89)cc(-c8ccnc9ccccc89)c7)cc6n5)cc4n3)c2)nc1.c1ccc(-c2cccc(-c3ccc4ccc(-c5ccc6ccc(-c7cccc(-c8ccc9ccc%10ccc(-c%11ccccc%11)nc%10c9n8)c7)cc6n5)cc4n3)c2)cc1.

What is the InChIKey of 7-[3,5-di(quinolin-4-yl)phenyl]-2-[2-(3-pyridin-2-ylphenyl)quinolin-7-yl]quinoline;2-phenyl-9-[3-[2-[2-(3-phenylphenyl)quinolin-7-yl]quinolin-7-yl]phenyl]-1,10-phenanthroline?

The InChIKey is RCDIDWQTJRMKNQ-UHFFFAOYSA-N. The full InChI is InChI=1S/C54H34N4.C53H33N5/c1-3-9-35(10-4-1)41-13-7-15-44(31-41)48-27-23-38-18-22-46(34-52(38)55-48)49-28-24-37-17-21-43(33-51(37)56-49)42-14-8-16-45(32-42)50-30-26-40-20-19-39-25-29-47(36-11-5-2-6-12-36)57-53(39)54(40)58-50;1-3-13-50-45(10-1)43(23-26-55-50)41-29-40(30-42(31-41)44-24-27-56-51-14-4-2-11-46(44)51)36-17-15-34-20-22-49(58-52(34)32-36)39-18-16-35-19-21-48(57-53(35)33-39)38-9-7-8-37(28-38)47-12-5-6-25-54-47/h1-34H;1-33H.

What are the key properties of 7-[3,5-di(quinolin-4-yl)phenyl]-2-[2-(3-pyridin-2-ylphenyl)quinolin-7-yl]quinoline;2-phenyl-9-[3-[2-[2-(3-phenylphenyl)quinolin-7-yl]quinolin-7-yl]phenyl]-1,10-phenanthroline?

7-[3,5-di(quinolin-4-yl)phenyl]-2-[2-(3-pyridin-2-ylphenyl)quinolin-7-yl]quinoline;2-phenyl-9-[3-[2-[2-(3-phenylphenyl)quinolin-7-yl]quinolin-7-yl]phenyl]-1,10-phenanthroline has a molecular weight of 1478.78 g/mol, XLogP of 27.16, 12 rotatable bonds, 0 hydrogen bond donors, and 9 hydrogen bond acceptors.

Where does this data come from?

All data for 7-[3,5-di(quinolin-4-yl)phenyl]-2-[2-(3-pyridin-2-ylphenyl)quinolin-7-yl]quinoline;2-phenyl-9-[3-[2-[2-(3-phenylphenyl)quinolin-7-yl]quinolin-7-yl]phenyl]-1,10-phenanthroline is sourced from PubChem (CID 165060350), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).