2-[3-[4,6-bis(3-naphthalen-2-ylphenyl)-1,3,5-triazin-2-yl]-5-quinolin-2-ylphenyl]quinoline

C59H37N5 — CID 118582380

IUPAC2-[3-[4,6-bis(3-naphthalen-2-ylphenyl)-1,3,5-triazin-2-yl]-5-quinolin-2-ylphenyl]quinoline
SMILESc1cc(-c2ccc3ccccc3c2)cc(-c2nc(-c3cccc(-c4ccc5ccccc5c4)c3)nc(-c3cc(-c4ccc5ccccc5n4)cc(-c4ccc5ccccc5n4)c3)n2)c1
InChIInChI=1S/C59H37N5/c1-3-15-42-31-46(25-23-38(42)11-1)44-17-9-19-48(33-44)57-62-58(49-20-10-18-45(34-49)47-26-24-39-12-2-4-16-43(39)32-47)64-59(63-57)52-36-50(55-29-27-40-13-5-7-21-53(40)60-55)35-51(37-52)56-30-28-41-14-6-8-22-54(41)61-56/h1-37H
InChIKeyVLHXCMUGXVANNR-UHFFFAOYSA-N
MW815.98 g/mol
LogP14.94
Rot. Bonds7

About 2-[3-[4,6-bis(3-naphthalen-2-ylphenyl)-1,3,5-triazin-2-yl]-5-quinolin-2-ylphenyl]quinoline

2-[3-[4,6-bis(3-naphthalen-2-ylphenyl)-1,3,5-triazin-2-yl]-5-quinolin-2-ylphenyl]quinoline (PubChem CID 118582380) has the molecular formula C59H37N5 and a molecular weight of 815.98 g/mol. Its IUPAC name is 2-[3-[4,6-bis(3-naphthalen-2-ylphenyl)-1,3,5-triazin-2-yl]-5-quinolin-2-ylphenyl]quinoline.

Molecular Properties

Compound Name2-[3-[4,6-bis(3-naphthalen-2-ylphenyl)-1,3,5-triazin-2-yl]-5-quinolin-2-ylphenyl]quinoline
PubChem CID118582380
Molecular FormulaC59H37N5
Molecular Weight815.98 g/mol
Exact Mass815.30
IUPAC Name2-[3-[4,6-bis(3-naphthalen-2-ylphenyl)-1,3,5-triazin-2-yl]-5-quinolin-2-ylphenyl]quinoline
SMILESc1cc(-c2ccc3ccccc3c2)cc(-c2nc(-c3cccc(-c4ccc5ccccc5c4)c3)nc(-c3cc(-c4ccc5ccccc5n4)cc(-c4ccc5ccccc5n4)c3)n2)c1
InChIInChI=1S/C59H37N5/c1-3-15-42-31-46(25-23-38(42)11-1)44-17-9-19-48(33-44)57-62-58(49-20-10-18-45(34-49)47-26-24-39-12-2-4-16-43(39)32-47)64-59(63-57)52-36-50(55-29-27-40-13-5-7-21-53(40)60-55)35-51(37-52)56-30-28-41-14-6-8-22-54(41)61-56/h1-37H
InChIKeyVLHXCMUGXVANNR-UHFFFAOYSA-N
XLogP14.94
TPSA64.45 Ų
H-Bond Donors
H-Bond Acceptors5
Rotatable Bonds7
Heavy Atoms64
Complexity—

Lipinski Rule of Five

2 violations

RuleValue
MW ≤ 500815.98
LogP ≤ 514.94
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 105

Analyze 2-[3-[4,6-bis(3-naphthalen-2-ylphenyl)-1,3,5-triazin-2-yl]-5-quinolin-2-ylphenyl]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

2,4-diphenyl-6-[4-[4-phenyl-6-(3-phenylphenyl)-1,3,5-triazin-2-yl]phenyl]-1,3,5-triazine;2-[3-[3-(4,6-diphenyl-1,3,5-triazin-2-yl)phenyl]phenyl]quinoline
CID 160919258
2-[4-[3-[4-phenyl-6-(4-phenylphenyl)-1,3,5-triazin-2-yl]phenyl]phenyl]quinoline
CID 129265578
2-[3-(4,6-dinaphthalen-2-yl-1,3,5-triazin-2-yl)-5-isoquinolin-3-ylphenyl]quinoline
CID 118582341
2,4-bis(3,5-diphenylphenyl)-6-naphthalen-2-yl-1,3,5-triazine;2-[3,5-bis(4-naphthalen-2-ylphenyl)phenyl]naphthalene;2-naphthalen-2-yl-4,6-bis(3-naphthalen-2-ylphenyl)-1,3,5-triazine
CID 163792749
2,4-dinaphthalen-2-yl-6-[6-[3-(3-phenylphenyl)phenyl]naphthalen-2-yl]-1,3,5-triazine
CID 164745871
2-(4-chloro-6-naphthalen-2-yl-1,3,5-triazin-2-yl)quinoline
CID 156900627
2-[3-[3-(4,6-diphenyl-1,3,5-triazin-2-yl)phenyl]phenyl]-4-(4-naphthalen-2-ylphenyl)-6-phenyl-1,3,5-triazine
CID 154626597
2-naphthalen-2-yl-4-phenyl-6-(3-phenylphenyl)-1,3,5-triazine
CID 163794965
2,4-dinaphthalen-2-yl-6-[4-(3-phenylphenyl)phenyl]-1,3,5-triazine
CID 154589115
2-naphthalen-2-yl-4-phenyl-6-[3-[3-[3-(3-phenylphenyl)phenyl]phenyl]phenyl]-1,3,5-triazine
CID 122606651
2-(7-quinolin-2-ylnaphthalen-2-yl)quinoline
CID 176883836
2-[3-benzo[g]quinolin-2-yl-5-(3-quinolin-2-ylphenyl)phenyl]benzo[g]quinoline
CID 139363878

Frequently Asked Questions

What is the IUPAC name of 2-[3-[4,6-bis(3-naphthalen-2-ylphenyl)-1,3,5-triazin-2-yl]-5-quinolin-2-ylphenyl]quinoline?
The IUPAC name of 2-[3-[4,6-bis(3-naphthalen-2-ylphenyl)-1,3,5-triazin-2-yl]-5-quinolin-2-ylphenyl]quinoline (CID 118582380) is 2-[3-[4,6-bis(3-naphthalen-2-ylphenyl)-1,3,5-triazin-2-yl]-5-quinolin-2-ylphenyl]quinoline.
What is the SMILES notation for 2-[3-[4,6-bis(3-naphthalen-2-ylphenyl)-1,3,5-triazin-2-yl]-5-quinolin-2-ylphenyl]quinoline?
The canonical SMILES for 2-[3-[4,6-bis(3-naphthalen-2-ylphenyl)-1,3,5-triazin-2-yl]-5-quinolin-2-ylphenyl]quinoline is c1cc(-c2ccc3ccccc3c2)cc(-c2nc(-c3cccc(-c4ccc5ccccc5c4)c3)nc(-c3cc(-c4ccc5ccccc5n4)cc(-c4ccc5ccccc5n4)c3)n2)c1.
What is the InChIKey of 2-[3-[4,6-bis(3-naphthalen-2-ylphenyl)-1,3,5-triazin-2-yl]-5-quinolin-2-ylphenyl]quinoline?
The InChIKey is VLHXCMUGXVANNR-UHFFFAOYSA-N. The full InChI is InChI=1S/C59H37N5/c1-3-15-42-31-46(25-23-38(42)11-1)44-17-9-19-48(33-44)57-62-58(49-20-10-18-45(34-49)47-26-24-39-12-2-4-16-43(39)32-47)64-59(63-57)52-36-50(55-29-27-40-13-5-7-21-53(40)60-55)35-51(37-52)56-30-28-41-14-6-8-22-54(41)61-56/h1-37H.
What are the key properties of 2-[3-[4,6-bis(3-naphthalen-2-ylphenyl)-1,3,5-triazin-2-yl]-5-quinolin-2-ylphenyl]quinoline?
2-[3-[4,6-bis(3-naphthalen-2-ylphenyl)-1,3,5-triazin-2-yl]-5-quinolin-2-ylphenyl]quinoline has a molecular weight of 815.98 g/mol, XLogP of 14.94, 7 rotatable bonds, 0 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 2-[3-[4,6-bis(3-naphthalen-2-ylphenyl)-1,3,5-triazin-2-yl]-5-quinolin-2-ylphenyl]quinoline is sourced from PubChem (CID 118582380), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).