6-(3,5-dinaphthalen-2-ylphenyl)-2,4-diphenylquinazoline;2,4-diphenyl-6-(4-phenylnaphthalen-1-yl)quinazoline;2,4-diphenyl-6-triphenylen-2-ylquinazoline

C120H78N6 — CID 158031758

IUPAC6-(3,5-dinaphthalen-2-ylphenyl)-2,4-diphenylquinazoline;2,4-diphenyl-6-(4-phenylnaphthalen-1-yl)quinazoline;2,4-diphenyl-6-triphenylen-2-ylquinazoline
SMILESc1ccc(-c2nc(-c3ccccc3)c3cc(-c4cc(-c5ccc6ccccc6c5)cc(-c5ccc6ccccc6c5)c4)ccc3n2)cc1.c1ccc(-c2nc(-c3ccccc3)c3cc(-c4ccc(-c5ccccc5)c5ccccc45)ccc3n2)cc1.c1ccc(-c2nc(-c3ccccc3)c3cc(-c4ccc5c6ccccc6c6ccccc6c5c4)ccc3n2)cc1
InChIInChI=1S/C46H30N2.C38H24N2.C36H24N2/c1-3-13-33(14-4-1)45-43-30-39(23-24-44(43)47-46(48-45)34-15-5-2-6-16-34)42-28-40(37-21-19-31-11-7-9-17-35(31)25-37)27-41(29-42)38-22-20-32-12-8-10-18-36(32)26-38;1-3-11-25(12-4-1)37-35-24-28(20-22-36(35)39-38(40-37)26-13-5-2-6-14-26)27-19-21-33-31-17-8-7-15-29(31)30-16-9-10-18-32(30)34(33)23-27;1-4-12-25(13-5-1)29-21-22-30(32-19-11-10-18-31(29)32)28-20-23-34-33(24-28)35(26-14-6-2-7-15-26)38-36(37-34)27-16-8-3-9-17-27/h1-30H;1-24H;1-24H
InChIKeyFHGLPWCSFWLOTO-UHFFFAOYSA-N
MW1603.99 g/mol
LogP31.81
Rot. Bonds12

About 6-(3,5-dinaphthalen-2-ylphenyl)-2,4-diphenylquinazoline;2,4-diphenyl-6-(4-phenylnaphthalen-1-yl)quinazoline;2,4-diphenyl-6-triphenylen-2-ylquinazoline

6-(3,5-dinaphthalen-2-ylphenyl)-2,4-diphenylquinazoline;2,4-diphenyl-6-(4-phenylnaphthalen-1-yl)quinazoline;2,4-diphenyl-6-triphenylen-2-ylquinazoline (PubChem CID 158031758) has the molecular formula C120H78N6 and a molecular weight of 1603.99 g/mol. Its IUPAC name is 6-(3,5-dinaphthalen-2-ylphenyl)-2,4-diphenylquinazoline;2,4-diphenyl-6-(4-phenylnaphthalen-1-yl)quinazoline;2,4-diphenyl-6-triphenylen-2-ylquinazoline.

Molecular Properties

Compound Name6-(3,5-dinaphthalen-2-ylphenyl)-2,4-diphenylquinazoline;2,4-diphenyl-6-(4-phenylnaphthalen-1-yl)quinazoline;2,4-diphenyl-6-triphenylen-2-ylquinazoline
PubChem CID158031758
Molecular FormulaC120H78N6
Molecular Weight1603.99 g/mol
Exact Mass1602.63
IUPAC Name6-(3,5-dinaphthalen-2-ylphenyl)-2,4-diphenylquinazoline;2,4-diphenyl-6-(4-phenylnaphthalen-1-yl)quinazoline;2,4-diphenyl-6-triphenylen-2-ylquinazoline
SMILESc1ccc(-c2nc(-c3ccccc3)c3cc(-c4cc(-c5ccc6ccccc6c5)cc(-c5ccc6ccccc6c5)c4)ccc3n2)cc1.c1ccc(-c2nc(-c3ccccc3)c3cc(-c4ccc(-c5ccccc5)c5ccccc45)ccc3n2)cc1.c1ccc(-c2nc(-c3ccccc3)c3cc(-c4ccc5c6ccccc6c6ccccc6c5c4)ccc3n2)cc1
InChIInChI=1S/C46H30N2.C38H24N2.C36H24N2/c1-3-13-33(14-4-1)45-43-30-39(23-24-44(43)47-46(48-45)34-15-5-2-6-16-34)42-28-40(37-21-19-31-11-7-9-17-35(31)25-37)27-41(29-42)38-22-20-32-12-8-10-18-36(32)26-38;1-3-11-25(12-4-1)37-35-24-28(20-22-36(35)39-38(40-37)26-13-5-2-6-14-26)27-19-21-33-31-17-8-7-15-29(31)30-16-9-10-18-32(30)34(33)23-27;1-4-12-25(13-5-1)29-21-22-30(32-19-11-10-18-31(29)32)28-20-23-34-33(24-28)35(26-14-6-2-7-15-26)38-36(37-34)27-16-8-3-9-17-27/h1-30H;1-24H;1-24H
InChIKeyFHGLPWCSFWLOTO-UHFFFAOYSA-N
XLogP31.81
TPSA77.34 Ų
H-Bond Donors
H-Bond Acceptors6
Rotatable Bonds12
Heavy Atoms126
Complexity—

Lipinski Rule of Five

2 violations

RuleValue
MW ≤ 5001603.99
LogP ≤ 531.81
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 106

Computed Properties (RDKit)

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

Analyze 6-(3,5-dinaphthalen-2-ylphenyl)-2,4-diphenylquinazoline;2,4-diphenyl-6-(4-phenylnaphthalen-1-yl)quinazoline;2,4-diphenyl-6-triphenylen-2-ylquinazoline with MolForge

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Related Compounds

2,4-diphenyl-6-(3-phenyl-5-triphenylen-2-ylphenyl)-1,3,5-triazine;2-(4-naphthalen-2-ylphenyl)-4-phenyl-6-triphenylen-2-yl-1,3,5-triazine
CID 159317711
2-[4-[6-(3-naphthalen-2-ylphenyl)naphthalen-2-yl]naphthalen-1-yl]-4,6-diphenyl-1,3,5-triazine
CID 174244175
1,6-dinaphthalen-2-yl-4-phenylnaphthalene
CID 159069620
2-(3-naphthalen-2-ylphenyl)-9-[4-[4-phenyl-2-(4-phenylphenyl)quinazolin-6-yl]phenyl]-1,10-phenanthroline
CID 134167704
1-[4-[4-[3-(3-naphthalen-2-ylphenyl)phenyl]phenyl]phenyl]-3-phenylbenzo[f]quinazoline
CID 118529244
2,5-bis(3,5-diphenylphenyl)quinazoline;2,4-bis(4-naphthalen-2-ylphenyl)quinazoline;2,4-bis[4-(3-phenylphenyl)phenyl]quinazoline
CID 163717750
2-triphenylen-2-yl-4-[6-(4-triphenylen-2-ylquinazolin-2-yl)naphthalen-2-yl]quinazoline
CID 163611723
9-[3-(7-naphthalen-2-ylnaphthalen-2-yl)phenyl]phenanthrene;3-[3-(6-naphthalen-2-ylnaphthalen-2-yl)phenyl]-10-(3-phenylphenyl)phenanthrene;9-[6-(3-naphthalen-2-ylphenyl)naphthalen-2-yl]phenanthrene;9-[3-(7-phenanthren-9-ylnaphthalen-2-yl)phenyl]phenanthrene;9-[4-[4-(4-phenanthren-9-ylphenyl)naphthalen-1-yl]phenyl]phenanthrene
CID 159137471
2-naphthalen-2-yl-4-phenanthren-2-yl-6-[3-(4-phenylnaphthalen-1-yl)phenyl]-1,3,5-triazine
CID 174232916
2-[3-(6-naphthalen-2-ylnaphthalen-2-yl)phenyl]-4,6-bis(4-phenylphenyl)-1,3,5-triazine;2-[3-(6-naphthalen-2-ylnaphthalen-2-yl)phenyl]-4-phenyl-6-(4-phenylnaphthalen-1-yl)-1,3,5-triazine
CID 164975629
2-(3-naphthalen-2-yl-5-triphenylen-2-ylphenyl)triphenylene
CID 123747688
2-(4-chrysen-2-ylnaphthalen-1-yl)-4,6-diphenyl-1,3,5-triazine;2-(4-chrysen-2-ylphenyl)-4-naphthalen-2-yl-6-phenyl-1,3,5-triazine
CID 157258126

Frequently Asked Questions

What is the IUPAC name of 6-(3,5-dinaphthalen-2-ylphenyl)-2,4-diphenylquinazoline;2,4-diphenyl-6-(4-phenylnaphthalen-1-yl)quinazoline;2,4-diphenyl-6-triphenylen-2-ylquinazoline?
The IUPAC name of 6-(3,5-dinaphthalen-2-ylphenyl)-2,4-diphenylquinazoline;2,4-diphenyl-6-(4-phenylnaphthalen-1-yl)quinazoline;2,4-diphenyl-6-triphenylen-2-ylquinazoline (CID 158031758) is 6-(3,5-dinaphthalen-2-ylphenyl)-2,4-diphenylquinazoline;2,4-diphenyl-6-(4-phenylnaphthalen-1-yl)quinazoline;2,4-diphenyl-6-triphenylen-2-ylquinazoline.
What is the SMILES notation for 6-(3,5-dinaphthalen-2-ylphenyl)-2,4-diphenylquinazoline;2,4-diphenyl-6-(4-phenylnaphthalen-1-yl)quinazoline;2,4-diphenyl-6-triphenylen-2-ylquinazoline?
The canonical SMILES for 6-(3,5-dinaphthalen-2-ylphenyl)-2,4-diphenylquinazoline;2,4-diphenyl-6-(4-phenylnaphthalen-1-yl)quinazoline;2,4-diphenyl-6-triphenylen-2-ylquinazoline is c1ccc(-c2nc(-c3ccccc3)c3cc(-c4cc(-c5ccc6ccccc6c5)cc(-c5ccc6ccccc6c5)c4)ccc3n2)cc1.c1ccc(-c2nc(-c3ccccc3)c3cc(-c4ccc(-c5ccccc5)c5ccccc45)ccc3n2)cc1.c1ccc(-c2nc(-c3ccccc3)c3cc(-c4ccc5c6ccccc6c6ccccc6c5c4)ccc3n2)cc1.
What is the InChIKey of 6-(3,5-dinaphthalen-2-ylphenyl)-2,4-diphenylquinazoline;2,4-diphenyl-6-(4-phenylnaphthalen-1-yl)quinazoline;2,4-diphenyl-6-triphenylen-2-ylquinazoline?
The InChIKey is FHGLPWCSFWLOTO-UHFFFAOYSA-N. The full InChI is InChI=1S/C46H30N2.C38H24N2.C36H24N2/c1-3-13-33(14-4-1)45-43-30-39(23-24-44(43)47-46(48-45)34-15-5-2-6-16-34)42-28-40(37-21-19-31-11-7-9-17-35(31)25-37)27-41(29-42)38-22-20-32-12-8-10-18-36(32)26-38;1-3-11-25(12-4-1)37-35-24-28(20-22-36(35)39-38(40-37)26-13-5-2-6-14-26)27-19-21-33-31-17-8-7-15-29(31)30-16-9-10-18-32(30)34(33)23-27;1-4-12-25(13-5-1)29-21-22-30(32-19-11-10-18-31(29)32)28-20-23-34-33(24-28)35(26-14-6-2-7-15-26)38-36(37-34)27-16-8-3-9-17-27/h1-30H;1-24H;1-24H.
What are the key properties of 6-(3,5-dinaphthalen-2-ylphenyl)-2,4-diphenylquinazoline;2,4-diphenyl-6-(4-phenylnaphthalen-1-yl)quinazoline;2,4-diphenyl-6-triphenylen-2-ylquinazoline?
6-(3,5-dinaphthalen-2-ylphenyl)-2,4-diphenylquinazoline;2,4-diphenyl-6-(4-phenylnaphthalen-1-yl)quinazoline;2,4-diphenyl-6-triphenylen-2-ylquinazoline has a molecular weight of 1603.99 g/mol, XLogP of 31.81, 12 rotatable bonds, 0 hydrogen bond donors, and 6 hydrogen bond acceptors.
Where does this data come from?
All data for 6-(3,5-dinaphthalen-2-ylphenyl)-2,4-diphenylquinazoline;2,4-diphenyl-6-(4-phenylnaphthalen-1-yl)quinazoline;2,4-diphenyl-6-triphenylen-2-ylquinazoline is sourced from PubChem (CID 158031758), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).