2-[4-(2,6-diphenyl-4-pyridinyl)phenyl]-4,6-dinaphthalen-2-ylbenzo[h]quinoline;2-[4-(4,6-diphenyl-2-pyridinyl)phenyl]-4,6-dinaphthalen-2-ylbenzo[h]quinoline

C112H72N4 — CID 158566258

IUPAC2-[4-(2,6-diphenyl-4-pyridinyl)phenyl]-4,6-dinaphthalen-2-ylbenzo[h]quinoline;2-[4-(4,6-diphenyl-2-pyridinyl)phenyl]-4,6-dinaphthalen-2-ylbenzo[h]quinoline
SMILESc1ccc(-c2cc(-c3ccc(-c4cc(-c5ccc6ccccc6c5)c5cc(-c6ccc7ccccc7c6)c6ccccc6c5n4)cc3)cc(-c3ccccc3)n2)cc1.c1ccc(-c2cc(-c3ccccc3)nc(-c3ccc(-c4cc(-c5ccc6ccccc6c5)c5cc(-c6ccc7ccccc7c6)c6ccccc6c5n4)cc3)c2)cc1
InChIInChI=1S/2C56H36N2/c1-3-15-40(16-4-1)53-33-47(34-54(57-53)41-17-5-2-6-18-41)39-23-27-42(28-24-39)55-36-51(46-30-26-38-14-8-10-20-44(38)32-46)52-35-50(48-21-11-12-22-49(48)56(52)58-55)45-29-25-37-13-7-9-19-43(37)31-45;1-3-13-37(14-4-1)47-33-53(40-17-5-2-6-18-40)57-54(34-47)41-25-27-42(28-26-41)55-36-51(46-30-24-39-16-8-10-20-44(39)32-46)52-35-50(48-21-11-12-22-49(48)56(52)58-55)45-29-23-38-15-7-9-19-43(38)31-45/h2*1-36H
InChIKeyHRMZUXIFQRGJFR-UHFFFAOYSA-N
MW1473.84 g/mol
LogP30.18
Rot. Bonds12

About 2-[4-(2,6-diphenyl-4-pyridinyl)phenyl]-4,6-dinaphthalen-2-ylbenzo[h]quinoline;2-[4-(4,6-diphenyl-2-pyridinyl)phenyl]-4,6-dinaphthalen-2-ylbenzo[h]quinoline

2-[4-(2,6-diphenyl-4-pyridinyl)phenyl]-4,6-dinaphthalen-2-ylbenzo[h]quinoline;2-[4-(4,6-diphenyl-2-pyridinyl)phenyl]-4,6-dinaphthalen-2-ylbenzo[h]quinoline (PubChem CID 158566258) has the molecular formula C112H72N4 and a molecular weight of 1473.84 g/mol. Its IUPAC name is 2-[4-(2,6-diphenyl-4-pyridinyl)phenyl]-4,6-dinaphthalen-2-ylbenzo[h]quinoline;2-[4-(4,6-diphenyl-2-pyridinyl)phenyl]-4,6-dinaphthalen-2-ylbenzo[h]quinoline.

Molecular Properties

Compound Name2-[4-(2,6-diphenyl-4-pyridinyl)phenyl]-4,6-dinaphthalen-2-ylbenzo[h]quinoline;2-[4-(4,6-diphenyl-2-pyridinyl)phenyl]-4,6-dinaphthalen-2-ylbenzo[h]quinoline
PubChem CID158566258
Molecular FormulaC112H72N4
Molecular Weight1473.84 g/mol
Exact Mass1472.58
IUPAC Name2-[4-(2,6-diphenyl-4-pyridinyl)phenyl]-4,6-dinaphthalen-2-ylbenzo[h]quinoline;2-[4-(4,6-diphenyl-2-pyridinyl)phenyl]-4,6-dinaphthalen-2-ylbenzo[h]quinoline
SMILESc1ccc(-c2cc(-c3ccc(-c4cc(-c5ccc6ccccc6c5)c5cc(-c6ccc7ccccc7c6)c6ccccc6c5n4)cc3)cc(-c3ccccc3)n2)cc1.c1ccc(-c2cc(-c3ccccc3)nc(-c3ccc(-c4cc(-c5ccc6ccccc6c5)c5cc(-c6ccc7ccccc7c6)c6ccccc6c5n4)cc3)c2)cc1
InChIInChI=1S/2C56H36N2/c1-3-15-40(16-4-1)53-33-47(34-54(57-53)41-17-5-2-6-18-41)39-23-27-42(28-24-39)55-36-51(46-30-26-38-14-8-10-20-44(38)32-46)52-35-50(48-21-11-12-22-49(48)56(52)58-55)45-29-25-37-13-7-9-19-43(37)31-45;1-3-13-37(14-4-1)47-33-53(40-17-5-2-6-18-40)57-54(34-47)41-25-27-42(28-26-41)55-36-51(46-30-24-39-16-8-10-20-44(39)32-46)52-35-50(48-21-11-12-22-49(48)56(52)58-55)45-29-23-38-15-7-9-19-43(38)31-45/h2*1-36H
InChIKeyHRMZUXIFQRGJFR-UHFFFAOYSA-N
XLogP30.18
TPSA51.56 Ų
H-Bond Donors
H-Bond Acceptors4
Rotatable Bonds12
Heavy Atoms116
Complexity—

Lipinski Rule of Five

2 violations

RuleValue
MW ≤ 5001473.84
LogP ≤ 530.18
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 104

Computed Properties (RDKit)

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

Analyze 2-[4-(2,6-diphenyl-4-pyridinyl)phenyl]-4,6-dinaphthalen-2-ylbenzo[h]quinoline;2-[4-(4,6-diphenyl-2-pyridinyl)phenyl]-4,6-dinaphthalen-2-ylbenzo[h]quinoline with MolForge

Explore ADMET properties, 3D molecular structure, drug-likeness score, and discover similar compounds using our AI-powered platform.

Launch Full Analysis

Related Compounds

6-[4-(2,6-diphenyl-4-pyridinyl)phenyl]-2,4-diphenylbenzo[h]quinoline
CID 70958981
6-[4-(2,6-diphenyl-4-pyridinyl)phenyl]-2,4-bis(4-phenylphenyl)benzo[h]quinoline
CID 70836400
2,4-bis(4-phenylphenyl)-6-(4-quinolin-2-ylphenyl)benzo[h]quinoline;6-[4-(4,6-diphenyl-2-pyridinyl)phenyl]-2,4-dinaphthalen-2-ylbenzo[h]quinoline
CID 159967582
6-[4-(4,6-diphenyl-2-pyridinyl)phenyl]-2,4-di(triphenylen-2-yl)benzo[h]quinoline
CID 89137414
4,6-dinaphthalen-2-yl-2-(4-phenanthridin-6-ylphenyl)benzo[h]quinoline
CID 70958804
4,7-dinaphthalen-2-yl-2,9-diphenyl-1,10-phenanthroline
CID 70909440
4-[4-(4,6-diphenyl-2-pyridinyl)phenyl]-2,6-di(phenanthren-9-yl)benzo[h]quinoline
CID 89016586
4,6-dinaphthalen-2-yl-2-(4-quinolin-4-ylphenyl)benzo[h]quinoline
CID 70836414
2-[4-(2,6-diphenylpyrimidin-4-yl)phenyl]-4,6-bis(4-phenylphenyl)benzo[h]quinoline
CID 70836420
2,4-bis(4-phenylphenyl)-6-(4-quinolin-2-ylphenyl)benzo[h]quinoline
CID 70958913
4-[4-(9,10-dinaphthalen-2-ylanthracen-2-yl)phenyl]-2,6-diphenylpyridine
CID 90361557
2,6-diphenyl-4-[4-(12-phenylchrysen-6-yl)phenyl]pyridine
CID 155655416

Frequently Asked Questions

What is the IUPAC name of 2-[4-(2,6-diphenyl-4-pyridinyl)phenyl]-4,6-dinaphthalen-2-ylbenzo[h]quinoline;2-[4-(4,6-diphenyl-2-pyridinyl)phenyl]-4,6-dinaphthalen-2-ylbenzo[h]quinoline?
The IUPAC name of 2-[4-(2,6-diphenyl-4-pyridinyl)phenyl]-4,6-dinaphthalen-2-ylbenzo[h]quinoline;2-[4-(4,6-diphenyl-2-pyridinyl)phenyl]-4,6-dinaphthalen-2-ylbenzo[h]quinoline (CID 158566258) is 2-[4-(2,6-diphenyl-4-pyridinyl)phenyl]-4,6-dinaphthalen-2-ylbenzo[h]quinoline;2-[4-(4,6-diphenyl-2-pyridinyl)phenyl]-4,6-dinaphthalen-2-ylbenzo[h]quinoline.
What is the SMILES notation for 2-[4-(2,6-diphenyl-4-pyridinyl)phenyl]-4,6-dinaphthalen-2-ylbenzo[h]quinoline;2-[4-(4,6-diphenyl-2-pyridinyl)phenyl]-4,6-dinaphthalen-2-ylbenzo[h]quinoline?
The canonical SMILES for 2-[4-(2,6-diphenyl-4-pyridinyl)phenyl]-4,6-dinaphthalen-2-ylbenzo[h]quinoline;2-[4-(4,6-diphenyl-2-pyridinyl)phenyl]-4,6-dinaphthalen-2-ylbenzo[h]quinoline is c1ccc(-c2cc(-c3ccc(-c4cc(-c5ccc6ccccc6c5)c5cc(-c6ccc7ccccc7c6)c6ccccc6c5n4)cc3)cc(-c3ccccc3)n2)cc1.c1ccc(-c2cc(-c3ccccc3)nc(-c3ccc(-c4cc(-c5ccc6ccccc6c5)c5cc(-c6ccc7ccccc7c6)c6ccccc6c5n4)cc3)c2)cc1.
What is the InChIKey of 2-[4-(2,6-diphenyl-4-pyridinyl)phenyl]-4,6-dinaphthalen-2-ylbenzo[h]quinoline;2-[4-(4,6-diphenyl-2-pyridinyl)phenyl]-4,6-dinaphthalen-2-ylbenzo[h]quinoline?
The InChIKey is HRMZUXIFQRGJFR-UHFFFAOYSA-N. The full InChI is InChI=1S/2C56H36N2/c1-3-15-40(16-4-1)53-33-47(34-54(57-53)41-17-5-2-6-18-41)39-23-27-42(28-24-39)55-36-51(46-30-26-38-14-8-10-20-44(38)32-46)52-35-50(48-21-11-12-22-49(48)56(52)58-55)45-29-25-37-13-7-9-19-43(37)31-45;1-3-13-37(14-4-1)47-33-53(40-17-5-2-6-18-40)57-54(34-47)41-25-27-42(28-26-41)55-36-51(46-30-24-39-16-8-10-20-44(39)32-46)52-35-50(48-21-11-12-22-49(48)56(52)58-55)45-29-23-38-15-7-9-19-43(38)31-45/h2*1-36H.
What are the key properties of 2-[4-(2,6-diphenyl-4-pyridinyl)phenyl]-4,6-dinaphthalen-2-ylbenzo[h]quinoline;2-[4-(4,6-diphenyl-2-pyridinyl)phenyl]-4,6-dinaphthalen-2-ylbenzo[h]quinoline?
2-[4-(2,6-diphenyl-4-pyridinyl)phenyl]-4,6-dinaphthalen-2-ylbenzo[h]quinoline;2-[4-(4,6-diphenyl-2-pyridinyl)phenyl]-4,6-dinaphthalen-2-ylbenzo[h]quinoline has a molecular weight of 1473.84 g/mol, XLogP of 30.18, 12 rotatable bonds, 0 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 2-[4-(2,6-diphenyl-4-pyridinyl)phenyl]-4,6-dinaphthalen-2-ylbenzo[h]quinoline;2-[4-(4,6-diphenyl-2-pyridinyl)phenyl]-4,6-dinaphthalen-2-ylbenzo[h]quinoline is sourced from PubChem (CID 158566258), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).