3-[4-(9,10-dinaphthalen-2-ylanthracen-2-yl)phenyl]quinoline;1-[4-[4,6-di(phenanthren-9-yl)pyrimidin-2-yl]phenyl]isoquinoline;3-[3-(6-naphthalen-2-ylnaphthalen-2-yl)phenyl]fluoranthene;3-[3-[10-(3-pyridin-3-ylphenyl)anthracen-9-yl]phenyl]pyridine

C174H110N6 — CID 158301384

IUPAC3-[4-(9,10-dinaphthalen-2-ylanthracen-2-yl)phenyl]quinoline;1-[4-[4,6-di(phenanthren-9-yl)pyrimidin-2-yl]phenyl]isoquinoline;3-[3-(6-naphthalen-2-ylnaphthalen-2-yl)phenyl]fluoranthene;3-[3-[10-(3-pyridin-3-ylphenyl)anthracen-9-yl]phenyl]pyridine
SMILESc1cc(-c2ccc3cc(-c4ccc5ccccc5c4)ccc3c2)cc(-c2ccc3c4c(cccc24)-c2ccccc2-3)c1.c1ccc2c(-c3ccc(-c4nc(-c5cc6ccccc6c6ccccc56)cc(-c5cc6ccccc6c6ccccc56)n4)cc3)nccc2c1.c1ccc2cc(-c3c4ccccc4c(-c4ccc5ccccc5c4)c4cc(-c5ccc(-c6cnc7ccccc7c6)cc5)ccc34)ccc2c1.c1cncc(-c2cccc(-c3c4ccccc4c(-c4cccc(-c5cccnc5)c4)c4ccccc34)c2)c1
InChIInChI=1S/C49H31N.C47H29N3.C42H26.C36H24N2/c1-3-11-36-27-40(23-21-32(36)9-1)48-43-14-6-7-15-44(43)49(41-24-22-33-10-2-4-12-37(33)28-41)46-30-38(25-26-45(46)48)34-17-19-35(20-18-34)42-29-39-13-5-8-16-47(39)50-31-42;1-6-16-37-30(11-1)25-26-48-46(37)31-21-23-32(24-22-31)47-49-44(42-27-33-12-2-4-14-35(33)38-17-7-9-19-40(38)42)29-45(50-47)43-28-34-13-3-5-15-36(34)39-18-8-10-20-41(39)43;1-2-8-28-23-31(16-15-27(28)7-1)33-20-19-32-24-30(17-18-34(32)25-33)29-9-5-10-35(26-29)36-21-22-41-38-12-4-3-11-37(38)40-14-6-13-39(36)42(40)41;1-2-16-32-31(15-1)35(27-11-5-9-25(21-27)29-13-7-19-37-23-29)33-17-3-4-18-34(33)36(32)28-12-6-10-26(22-28)30-14-8-20-38-24-30/h1-31H;1-29H;1-26H;1-24H
InChIKeyGMNPPXQDXWLVLW-UHFFFAOYSA-N
MW2284.84 g/mol
LogP47.07
Rot. Bonds15

About 3-[4-(9,10-dinaphthalen-2-ylanthracen-2-yl)phenyl]quinoline;1-[4-[4,6-di(phenanthren-9-yl)pyrimidin-2-yl]phenyl]isoquinoline;3-[3-(6-naphthalen-2-ylnaphthalen-2-yl)phenyl]fluoranthene;3-[3-[10-(3-pyridin-3-ylphenyl)anthracen-9-yl]phenyl]pyridine

3-[4-(9,10-dinaphthalen-2-ylanthracen-2-yl)phenyl]quinoline;1-[4-[4,6-di(phenanthren-9-yl)pyrimidin-2-yl]phenyl]isoquinoline;3-[3-(6-naphthalen-2-ylnaphthalen-2-yl)phenyl]fluoranthene;3-[3-[10-(3-pyridin-3-ylphenyl)anthracen-9-yl]phenyl]pyridine (PubChem CID 158301384) has the molecular formula C174H110N6 and a molecular weight of 2284.84 g/mol. Its IUPAC name is 3-[4-(9,10-dinaphthalen-2-ylanthracen-2-yl)phenyl]quinoline;1-[4-[4,6-di(phenanthren-9-yl)pyrimidin-2-yl]phenyl]isoquinoline;3-[3-(6-naphthalen-2-ylnaphthalen-2-yl)phenyl]fluoranthene;3-[3-[10-(3-pyridin-3-ylphenyl)anthracen-9-yl]phenyl]pyridine.

Molecular Properties

Compound Name3-[4-(9,10-dinaphthalen-2-ylanthracen-2-yl)phenyl]quinoline;1-[4-[4,6-di(phenanthren-9-yl)pyrimidin-2-yl]phenyl]isoquinoline;3-[3-(6-naphthalen-2-ylnaphthalen-2-yl)phenyl]fluoranthene;3-[3-[10-(3-pyridin-3-ylphenyl)anthracen-9-yl]phenyl]pyridine
PubChem CID158301384
Molecular FormulaC174H110N6
Molecular Weight2284.84 g/mol
Exact Mass2282.88
IUPAC Name3-[4-(9,10-dinaphthalen-2-ylanthracen-2-yl)phenyl]quinoline;1-[4-[4,6-di(phenanthren-9-yl)pyrimidin-2-yl]phenyl]isoquinoline;3-[3-(6-naphthalen-2-ylnaphthalen-2-yl)phenyl]fluoranthene;3-[3-[10-(3-pyridin-3-ylphenyl)anthracen-9-yl]phenyl]pyridine
SMILESc1cc(-c2ccc3cc(-c4ccc5ccccc5c4)ccc3c2)cc(-c2ccc3c4c(cccc24)-c2ccccc2-3)c1.c1ccc2c(-c3ccc(-c4nc(-c5cc6ccccc6c6ccccc56)cc(-c5cc6ccccc6c6ccccc56)n4)cc3)nccc2c1.c1ccc2cc(-c3c4ccccc4c(-c4ccc5ccccc5c4)c4cc(-c5ccc(-c6cnc7ccccc7c6)cc5)ccc34)ccc2c1.c1cncc(-c2cccc(-c3c4ccccc4c(-c4cccc(-c5cccnc5)c4)c4ccccc34)c2)c1
InChIInChI=1S/C49H31N.C47H29N3.C42H26.C36H24N2/c1-3-11-36-27-40(23-21-32(36)9-1)48-43-14-6-7-15-44(43)49(41-24-22-33-10-2-4-12-37(33)28-41)46-30-38(25-26-45(46)48)34-17-19-35(20-18-34)42-29-39-13-5-8-16-47(39)50-31-42;1-6-16-37-30(11-1)25-26-48-46(37)31-21-23-32(24-22-31)47-49-44(42-27-33-12-2-4-14-35(33)38-17-7-9-19-40(38)42)29-45(50-47)43-28-34-13-3-5-15-36(34)39-18-8-10-20-41(39)43;1-2-8-28-23-31(16-15-27(28)7-1)33-20-19-32-24-30(17-18-34(32)25-33)29-9-5-10-35(26-29)36-21-22-41-38-12-4-3-11-37(38)40-14-6-13-39(36)42(40)41;1-2-16-32-31(15-1)35(27-11-5-9-25(21-27)29-13-7-19-37-23-29)33-17-3-4-18-34(33)36(32)28-12-6-10-26(22-28)30-14-8-20-38-24-30/h1-31H;1-29H;1-26H;1-24H
InChIKeyGMNPPXQDXWLVLW-UHFFFAOYSA-N
XLogP47.07
TPSA77.34 Ų
H-Bond Donors
H-Bond Acceptors6
Rotatable Bonds15
Heavy Atoms180
Complexity—

Lipinski Rule of Five

2 violations

RuleValue
MW ≤ 5002284.84
LogP ≤ 547.07
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 106

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'Polycyclic_aromatic_hydrocarbon_2', 'substructure': 'N/A'}, {'alert_name': 'Polycyclic_aromatic_hydrocarbon_3', 'substructure': 'N/A'}

Analyze 3-[4-(9,10-dinaphthalen-2-ylanthracen-2-yl)phenyl]quinoline;1-[4-[4,6-di(phenanthren-9-yl)pyrimidin-2-yl]phenyl]isoquinoline;3-[3-(6-naphthalen-2-ylnaphthalen-2-yl)phenyl]fluoranthene;3-[3-[10-(3-pyridin-3-ylphenyl)anthracen-9-yl]phenyl]pyridine with MolForge

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Related Compounds

3-[5-(9,10-dinaphthalen-2-ylanthracen-2-yl)-2-pyridinyl]quinoline;4,6-di(phenanthren-9-yl)-2-(4-phenylphenyl)pyrimidine;2-[4-[2-naphthalen-1-yl-10-(4-pyridin-2-ylphenyl)anthracen-9-yl]phenyl]pyridine
CID 158905185
8-[4-(4,6-dinaphthalen-2-yl-1,3,5-triazin-2-yl)phenyl]quinoline;1-[4-[4,6-di(phenanthren-9-yl)pyrimidin-2-yl]phenyl]isoquinoline;3-[4-[4,6-di(phenanthren-9-yl)-1,3,5-triazin-2-yl]phenyl]quinoline
CID 160773519
4-(4-fluoranthen-3-ylphenyl)-2-(4-phenanthren-9-ylphenyl)-6-(4-pyridin-3-ylphenyl)pyrimidine
CID 130264454
2-[3,5-di(fluoranthen-3-yl)phenyl]-4-naphthalen-2-yl-6-(4-pyridin-3-ylphenyl)-1,3,5-triazine
CID 153466310
4-(3-naphthalen-2-ylphenyl)-2-(3-phenylphenyl)-6-(4-pyridin-3-ylphenyl)pyrimidine;4-(3-phenanthren-9-ylphenyl)-6-(4-pyridin-3-ylphenyl)-2-(4-triphenylen-2-ylphenyl)pyrimidine
CID 159291007
2-(3-naphthalen-2-ylphenyl)-4-(4-naphthalen-1-ylphenyl)-6-(4-pyridin-3-ylphenyl)pyrimidine;4-(3-naphthalen-2-ylphenyl)-2-(3-phenanthren-9-ylphenyl)-6-(4-pyridin-3-ylphenyl)pyrimidine;4-(3-naphthalen-2-ylphenyl)-2-(3-phenylphenyl)-6-(4-pyridin-3-ylphenyl)pyrimidine
CID 161484198
3-[2-[3-(6-phenylpyren-1-yl)phenyl]-6-(2-pyridin-3-ylphenyl)pyrimidin-4-yl]quinoline
CID 118314083
6-benzo[k]fluoranthen-3-yl-3-(3-naphthalen-2-ylphenyl)quinoline
CID 121287572
4-[4-(4-fluoranthen-3-ylphenyl)phenyl]-2-phenyl-6-(3-pyridin-3-ylphenyl)pyrimidine
CID 130264228
4-(4-fluoranthen-3-ylphenyl)-2-(4-phenylphenyl)-6-(3-pyridin-3-ylphenyl)pyrimidine
CID 130265025
3-[4-[3-[2,6-di(quinolin-3-yl)pyrimidin-4-yl]phenyl]-6-quinolin-3-ylpyrimidin-2-yl]quinoline;2-naphthalen-2-yl-4-[4-[4-(4-naphthalen-2-yl-6-phenylpyrimidin-2-yl)phenyl]phenyl]-6-phenylpyrimidine;3-[4-[2-naphthalen-2-yl-6-[3-[2-naphthalen-2-yl-6-(4-quinolin-3-ylphenyl)pyrimidin-4-yl]phenyl]pyrimidin-4-yl]phenyl]quinoline;3-[4-[4-naphthalen-2-yl-6-[3-[6-naphthalen-2-yl-2-(4-quinolin-3-ylphenyl)pyrimidin-4-yl]phenyl]pyrimidin-2-yl]phenyl]quinoline;3-[4-[2-phenanthren-9-yl-6-[3-[2-phenanthren-9-yl-6-(4-quinolin-3-ylphenyl)pyrimidin-4-yl]phenyl]pyrimidin-4-yl]phenyl]quinoline;3-[4-[4-phenanthren-9-yl-6-[3-[6-phenanthren-9-yl-2-(4-quinolin-3-ylphenyl)pyrimidin-4-yl]phenyl]pyrimidin-2-yl]phenyl]quinoline
CID 157214730
4-(4-fluoranthen-3-ylphenyl)-6-(4-phenylphenyl)-2-(3-pyridin-3-ylphenyl)pyrimidine
CID 130264975

Frequently Asked Questions

What is the IUPAC name of 3-[4-(9,10-dinaphthalen-2-ylanthracen-2-yl)phenyl]quinoline;1-[4-[4,6-di(phenanthren-9-yl)pyrimidin-2-yl]phenyl]isoquinoline;3-[3-(6-naphthalen-2-ylnaphthalen-2-yl)phenyl]fluoranthene;3-[3-[10-(3-pyridin-3-ylphenyl)anthracen-9-yl]phenyl]pyridine?
The IUPAC name of 3-[4-(9,10-dinaphthalen-2-ylanthracen-2-yl)phenyl]quinoline;1-[4-[4,6-di(phenanthren-9-yl)pyrimidin-2-yl]phenyl]isoquinoline;3-[3-(6-naphthalen-2-ylnaphthalen-2-yl)phenyl]fluoranthene;3-[3-[10-(3-pyridin-3-ylphenyl)anthracen-9-yl]phenyl]pyridine (CID 158301384) is 3-[4-(9,10-dinaphthalen-2-ylanthracen-2-yl)phenyl]quinoline;1-[4-[4,6-di(phenanthren-9-yl)pyrimidin-2-yl]phenyl]isoquinoline;3-[3-(6-naphthalen-2-ylnaphthalen-2-yl)phenyl]fluoranthene;3-[3-[10-(3-pyridin-3-ylphenyl)anthracen-9-yl]phenyl]pyridine.
What is the SMILES notation for 3-[4-(9,10-dinaphthalen-2-ylanthracen-2-yl)phenyl]quinoline;1-[4-[4,6-di(phenanthren-9-yl)pyrimidin-2-yl]phenyl]isoquinoline;3-[3-(6-naphthalen-2-ylnaphthalen-2-yl)phenyl]fluoranthene;3-[3-[10-(3-pyridin-3-ylphenyl)anthracen-9-yl]phenyl]pyridine?
The canonical SMILES for 3-[4-(9,10-dinaphthalen-2-ylanthracen-2-yl)phenyl]quinoline;1-[4-[4,6-di(phenanthren-9-yl)pyrimidin-2-yl]phenyl]isoquinoline;3-[3-(6-naphthalen-2-ylnaphthalen-2-yl)phenyl]fluoranthene;3-[3-[10-(3-pyridin-3-ylphenyl)anthracen-9-yl]phenyl]pyridine is c1cc(-c2ccc3cc(-c4ccc5ccccc5c4)ccc3c2)cc(-c2ccc3c4c(cccc24)-c2ccccc2-3)c1.c1ccc2c(-c3ccc(-c4nc(-c5cc6ccccc6c6ccccc56)cc(-c5cc6ccccc6c6ccccc56)n4)cc3)nccc2c1.c1ccc2cc(-c3c4ccccc4c(-c4ccc5ccccc5c4)c4cc(-c5ccc(-c6cnc7ccccc7c6)cc5)ccc34)ccc2c1.c1cncc(-c2cccc(-c3c4ccccc4c(-c4cccc(-c5cccnc5)c4)c4ccccc34)c2)c1.
What is the InChIKey of 3-[4-(9,10-dinaphthalen-2-ylanthracen-2-yl)phenyl]quinoline;1-[4-[4,6-di(phenanthren-9-yl)pyrimidin-2-yl]phenyl]isoquinoline;3-[3-(6-naphthalen-2-ylnaphthalen-2-yl)phenyl]fluoranthene;3-[3-[10-(3-pyridin-3-ylphenyl)anthracen-9-yl]phenyl]pyridine?
The InChIKey is GMNPPXQDXWLVLW-UHFFFAOYSA-N. The full InChI is InChI=1S/C49H31N.C47H29N3.C42H26.C36H24N2/c1-3-11-36-27-40(23-21-32(36)9-1)48-43-14-6-7-15-44(43)49(41-24-22-33-10-2-4-12-37(33)28-41)46-30-38(25-26-45(46)48)34-17-19-35(20-18-34)42-29-39-13-5-8-16-47(39)50-31-42;1-6-16-37-30(11-1)25-26-48-46(37)31-21-23-32(24-22-31)47-49-44(42-27-33-12-2-4-14-35(33)38-17-7-9-19-40(38)42)29-45(50-47)43-28-34-13-3-5-15-36(34)39-18-8-10-20-41(39)43;1-2-8-28-23-31(16-15-27(28)7-1)33-20-19-32-24-30(17-18-34(32)25-33)29-9-5-10-35(26-29)36-21-22-41-38-12-4-3-11-37(38)40-14-6-13-39(36)42(40)41;1-2-16-32-31(15-1)35(27-11-5-9-25(21-27)29-13-7-19-37-23-29)33-17-3-4-18-34(33)36(32)28-12-6-10-26(22-28)30-14-8-20-38-24-30/h1-31H;1-29H;1-26H;1-24H.
What are the key properties of 3-[4-(9,10-dinaphthalen-2-ylanthracen-2-yl)phenyl]quinoline;1-[4-[4,6-di(phenanthren-9-yl)pyrimidin-2-yl]phenyl]isoquinoline;3-[3-(6-naphthalen-2-ylnaphthalen-2-yl)phenyl]fluoranthene;3-[3-[10-(3-pyridin-3-ylphenyl)anthracen-9-yl]phenyl]pyridine?
3-[4-(9,10-dinaphthalen-2-ylanthracen-2-yl)phenyl]quinoline;1-[4-[4,6-di(phenanthren-9-yl)pyrimidin-2-yl]phenyl]isoquinoline;3-[3-(6-naphthalen-2-ylnaphthalen-2-yl)phenyl]fluoranthene;3-[3-[10-(3-pyridin-3-ylphenyl)anthracen-9-yl]phenyl]pyridine has a molecular weight of 2284.84 g/mol, XLogP of 47.07, 15 rotatable bonds, 0 hydrogen bond donors, and 6 hydrogen bond acceptors.
Where does this data come from?
All data for 3-[4-(9,10-dinaphthalen-2-ylanthracen-2-yl)phenyl]quinoline;1-[4-[4,6-di(phenanthren-9-yl)pyrimidin-2-yl]phenyl]isoquinoline;3-[3-(6-naphthalen-2-ylnaphthalen-2-yl)phenyl]fluoranthene;3-[3-[10-(3-pyridin-3-ylphenyl)anthracen-9-yl]phenyl]pyridine is sourced from PubChem (CID 158301384), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).