2,4-dinaphthalen-2-yl-6-phenanthren-2-yl-1,3,5-triazine;2-naphthalen-2-yl-4-phenanthren-2-yl-6-phenyl-1,3,5-triazine;2-phenanthren-2-yl-4,6-diphenylpyridine;2-phenanthren-2-yl-4,6-diphenylpyrimidine;2-phenanthren-2-yl-4,6-diphenyl-1,3,5-triazine;5-[2-[7-(4-quinolin-5-yl-2-pyridinyl)phenanthren-2-yl]-4-pyridinyl]quinoline

C202H130N16 — CID 158449062

IUPAC2,4-dinaphthalen-2-yl-6-phenanthren-2-yl-1,3,5-triazine;2-naphthalen-2-yl-4-phenanthren-2-yl-6-phenyl-1,3,5-triazine;2-phenanthren-2-yl-4,6-diphenylpyridine;2-phenanthren-2-yl-4,6-diphenylpyrimidine;2-phenanthren-2-yl-4,6-diphenyl-1,3,5-triazine;5-[2-[7-(4-quinolin-5-yl-2-pyridinyl)phenanthren-2-yl]-4-pyridinyl]quinoline
SMILESc1cc(-c2ccnc(-c3ccc4c(ccc5cc(-c6cc(-c7cccc8ncccc78)ccn6)ccc54)c3)c2)c2cccnc2c1.c1ccc(-c2cc(-c3ccccc3)nc(-c3ccc4c(ccc5ccccc54)c3)c2)cc1.c1ccc(-c2cc(-c3ccccc3)nc(-c3ccc4c(ccc5ccccc54)c3)n2)cc1.c1ccc(-c2nc(-c3ccc4ccccc4c3)nc(-c3ccc4c(ccc5ccccc54)c3)n2)cc1.c1ccc(-c2nc(-c3ccccc3)nc(-c3ccc4c(ccc5ccccc54)c3)n2)cc1.c1ccc2cc(-c3nc(-c4ccc5ccccc5c4)nc(-c4ccc5c(ccc6ccccc65)c4)n3)ccc2c1
InChIInChI=1S/C42H26N4.C37H23N3.C33H21N3.C31H21N.C30H20N2.C29H19N3/c1-5-33(37-7-3-19-43-39(37)9-1)29-17-21-45-41(25-29)31-13-15-35-27(23-31)11-12-28-24-32(14-16-36(28)35)42-26-30(18-22-46-42)34-6-2-10-40-38(34)8-4-20-44-40;1-3-10-27-21-30(17-13-24(27)7-1)35-38-36(31-18-14-25-8-2-4-11-28(25)22-31)40-37(39-35)32-19-20-34-29(23-32)16-15-26-9-5-6-12-33(26)34;1-2-10-24(11-3-1)31-34-32(27-17-14-22-8-4-5-12-25(22)20-27)36-33(35-31)28-18-19-30-26(21-28)16-15-23-9-6-7-13-29(23)30;1-3-9-22(10-4-1)27-20-30(24-12-5-2-6-13-24)32-31(21-27)26-17-18-29-25(19-26)16-15-23-11-7-8-14-28(23)29;1-3-10-22(11-4-1)28-20-29(23-12-5-2-6-13-23)32-30(31-28)25-17-18-27-24(19-25)16-15-21-9-7-8-14-26(21)27;1-3-10-21(11-4-1)27-30-28(22-12-5-2-6-13-22)32-29(31-27)24-17-18-26-23(19-24)16-15-20-9-7-8-14-25(20)26/h1-26H;1-23H;1-21H;1-21H;1-20H;1-19H
InChIKeyHDTFYTOEPWVTJJ-UHFFFAOYSA-N
MW2781.37 g/mol
LogP51.72
Rot. Bonds19

About 2,4-dinaphthalen-2-yl-6-phenanthren-2-yl-1,3,5-triazine;2-naphthalen-2-yl-4-phenanthren-2-yl-6-phenyl-1,3,5-triazine;2-phenanthren-2-yl-4,6-diphenylpyridine;2-phenanthren-2-yl-4,6-diphenylpyrimidine;2-phenanthren-2-yl-4,6-diphenyl-1,3,5-triazine;5-[2-[7-(4-quinolin-5-yl-2-pyridinyl)phenanthren-2-yl]-4-pyridinyl]quinoline

2,4-dinaphthalen-2-yl-6-phenanthren-2-yl-1,3,5-triazine;2-naphthalen-2-yl-4-phenanthren-2-yl-6-phenyl-1,3,5-triazine;2-phenanthren-2-yl-4,6-diphenylpyridine;2-phenanthren-2-yl-4,6-diphenylpyrimidine;2-phenanthren-2-yl-4,6-diphenyl-1,3,5-triazine;5-[2-[7-(4-quinolin-5-yl-2-pyridinyl)phenanthren-2-yl]-4-pyridinyl]quinoline (PubChem CID 158449062) has the molecular formula C202H130N16 and a molecular weight of 2781.37 g/mol. Its IUPAC name is 2,4-dinaphthalen-2-yl-6-phenanthren-2-yl-1,3,5-triazine;2-naphthalen-2-yl-4-phenanthren-2-yl-6-phenyl-1,3,5-triazine;2-phenanthren-2-yl-4,6-diphenylpyridine;2-phenanthren-2-yl-4,6-diphenylpyrimidine;2-phenanthren-2-yl-4,6-diphenyl-1,3,5-triazine;5-[2-[7-(4-quinolin-5-yl-2-pyridinyl)phenanthren-2-yl]-4-pyridinyl]quinoline.

Molecular Properties

Compound Name2,4-dinaphthalen-2-yl-6-phenanthren-2-yl-1,3,5-triazine;2-naphthalen-2-yl-4-phenanthren-2-yl-6-phenyl-1,3,5-triazine;2-phenanthren-2-yl-4,6-diphenylpyridine;2-phenanthren-2-yl-4,6-diphenylpyrimidine;2-phenanthren-2-yl-4,6-diphenyl-1,3,5-triazine;5-[2-[7-(4-quinolin-5-yl-2-pyridinyl)phenanthren-2-yl]-4-pyridinyl]quinoline
PubChem CID158449062
Molecular FormulaC202H130N16
Molecular Weight2781.37 g/mol
Exact Mass2779.07
IUPAC Name2,4-dinaphthalen-2-yl-6-phenanthren-2-yl-1,3,5-triazine;2-naphthalen-2-yl-4-phenanthren-2-yl-6-phenyl-1,3,5-triazine;2-phenanthren-2-yl-4,6-diphenylpyridine;2-phenanthren-2-yl-4,6-diphenylpyrimidine;2-phenanthren-2-yl-4,6-diphenyl-1,3,5-triazine;5-[2-[7-(4-quinolin-5-yl-2-pyridinyl)phenanthren-2-yl]-4-pyridinyl]quinoline
SMILESc1cc(-c2ccnc(-c3ccc4c(ccc5cc(-c6cc(-c7cccc8ncccc78)ccn6)ccc54)c3)c2)c2cccnc2c1.c1ccc(-c2cc(-c3ccccc3)nc(-c3ccc4c(ccc5ccccc54)c3)c2)cc1.c1ccc(-c2cc(-c3ccccc3)nc(-c3ccc4c(ccc5ccccc54)c3)n2)cc1.c1ccc(-c2nc(-c3ccc4ccccc4c3)nc(-c3ccc4c(ccc5ccccc54)c3)n2)cc1.c1ccc(-c2nc(-c3ccccc3)nc(-c3ccc4c(ccc5ccccc54)c3)n2)cc1.c1ccc2cc(-c3nc(-c4ccc5ccccc5c4)nc(-c4ccc5c(ccc6ccccc65)c4)n3)ccc2c1
InChIInChI=1S/C42H26N4.C37H23N3.C33H21N3.C31H21N.C30H20N2.C29H19N3/c1-5-33(37-7-3-19-43-39(37)9-1)29-17-21-45-41(25-29)31-13-15-35-27(23-31)11-12-28-24-32(14-16-36(28)35)42-26-30(18-22-46-42)34-6-2-10-40-38(34)8-4-20-44-40;1-3-10-27-21-30(17-13-24(27)7-1)35-38-36(31-18-14-25-8-2-4-11-28(25)22-31)40-37(39-35)32-19-20-34-29(23-32)16-15-26-9-5-6-12-33(26)34;1-2-10-24(11-3-1)31-34-32(27-17-14-22-8-4-5-12-25(22)20-27)36-33(35-31)28-18-19-30-26(21-28)16-15-23-9-6-7-13-29(23)30;1-3-9-22(10-4-1)27-20-30(24-12-5-2-6-13-24)32-31(21-27)26-17-18-29-25(19-26)16-15-23-11-7-8-14-28(23)29;1-3-10-22(11-4-1)28-20-29(23-12-5-2-6-13-23)32-30(31-28)25-17-18-27-24(19-25)16-15-21-9-7-8-14-26(21)27;1-3-10-21(11-4-1)27-30-28(22-12-5-2-6-13-22)32-29(31-27)24-17-18-26-23(19-24)16-15-20-9-7-8-14-25(20)26/h1-26H;1-23H;1-21H;1-21H;1-20H;1-19H
InChIKeyHDTFYTOEPWVTJJ-UHFFFAOYSA-N
XLogP51.72
TPSA206.24 Ų
H-Bond Donors
H-Bond Acceptors16
Rotatable Bonds19
Heavy Atoms218
Complexity—

Lipinski Rule of Five

3 violations

RuleValue
MW ≤ 5002781.37
LogP ≤ 551.72
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 1016

Computed Properties (RDKit)

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

Analyze 2,4-dinaphthalen-2-yl-6-phenanthren-2-yl-1,3,5-triazine;2-naphthalen-2-yl-4-phenanthren-2-yl-6-phenyl-1,3,5-triazine;2-phenanthren-2-yl-4,6-diphenylpyridine;2-phenanthren-2-yl-4,6-diphenylpyrimidine;2-phenanthren-2-yl-4,6-diphenyl-1,3,5-triazine;5-[2-[7-(4-quinolin-5-yl-2-pyridinyl)phenanthren-2-yl]-4-pyridinyl]quinoline with MolForge

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Related Compounds

2-[3-[5-[3-(4,6-diphenyl-2-pyridinyl)phenyl]naphthalen-2-yl]phenyl]-4,6-diphenylpyridine;2-[5-(4,6-diphenyl-1,3,5-triazin-2-yl)naphthalen-2-yl]-4,6-diphenyl-1,3,5-triazine;2-naphthalen-1-yl-4-[5-(4-naphthalen-1-yl-6-phenyl-1,3,5-triazin-2-yl)naphthalen-2-yl]-6-phenyl-1,3,5-triazine;2-naphthalen-2-yl-4-[5-(4-naphthalen-2-yl-6-phenyl-1,3,5-triazin-2-yl)naphthalen-2-yl]-6-phenyl-1,3,5-triazine;2-phenyl-4-(4-phenylphenyl)-6-[5-[4-phenyl-6-(4-phenylphenyl)-1,3,5-triazin-2-yl]naphthalen-2-yl]-1,3,5-triazine
CID 158729829
4-phenanthren-2-yl-6-[4-[5-[4-(6-phenanthren-2-yl-2-phenylpyrimidin-4-yl)phenyl]naphthalen-1-yl]phenyl]-2-phenylpyrimidine
CID 122448075
6-anthracen-2-yl-4-naphthalen-2-yl-2-(2-phenyl-4-pyridinyl)pyridine-3-carbonitrile;4-naphthalen-2-yl-6-phenanthren-2-yl-2-(2-phenyl-4-pyridinyl)pyrimidine;4-(4-naphthalen-2-yl-6-phenanthren-2-ylpyrimidin-2-yl)benzo[h]quinoline;4-(4-naphthalen-2-yl-6-phenanthren-2-ylpyrimidin-2-yl)-1,5-naphthyridine;7-[4-(4-naphthalen-2-yl-6-phenanthren-2-ylpyrimidin-2-yl)-2-pyridinyl]quinoline;4-(4-naphthalen-2-yl-6-phenanthren-2-ylpyrimidin-2-yl)quinoline
CID 162003548
10-[3-[4-naphthalen-2-yl-6-(4-phenylphenyl)-1,3,5-triazin-2-yl]phenyl]naphtho[2,1-f]quinoline
CID 174287899
4-(4-naphthalen-1-ylphenyl)-6-(7-phenylphenanthren-2-yl)-2-(4-phenylphenyl)pyrimidine
CID 168844850
4-[4-(2,6-dinaphthalen-2-yl-4-pyridinyl)phenyl]quinoline
CID 122427626
3-[6-(8-naphthalen-1-ylphenanthren-3-yl)naphthalen-2-yl]-1,10-phenanthroline;2-phenanthren-2-yl-4,6-di(triphenylen-2-yl)pyridine;2-phenanthren-2-yl-4,6-di(triphenylen-2-yl)pyrimidine;2-phenanthren-2-yl-4,6-di(triphenylen-2-yl)-1,3,5-triazine;2-phenanthren-2-yl-4-(4-phenylphenyl)-6-triphenylen-2-yl-1,3,5-triazine;2-phenanthren-2-yl-4-phenyl-6-triphenylen-2-yl-1,3,5-triazine
CID 157409062
2,4-bis[3-[3-(4-naphthalen-1-ylphenyl)phenyl]phenyl]-6-phenyl-1,3,5-triazine;2-phenyl-4,6-bis[2-[3-(2-phenylphenyl)phenyl]phenyl]-1,3,5-triazine;2-phenyl-4,6-bis[2-[3-(3-phenylphenyl)phenyl]phenyl]-1,3,5-triazine;2-phenyl-4,6-bis[2-[3-(4-phenylphenyl)phenyl]phenyl]-1,3,5-triazine;2-phenyl-4,6-bis[2-[4-(3-phenylphenyl)phenyl]phenyl]-1,3,5-triazine;2-phenyl-4,6-bis[2-(3-phenylphenyl)phenyl]-1,3,5-triazine;2-phenyl-4,6-bis[2-(4-phenylphenyl)phenyl]-1,3,5-triazine;5-[4-[3-[3-[4-phenyl-6-[3-[3-(4-quinolin-5-ylphenyl)phenyl]phenyl]-1,3,5-triazin-2-yl]phenyl]phenyl]phenyl]quinoline
CID 161207659
2-[5-[4-(2,6-diphenyl-4-pyridinyl)phenyl]naphthalen-2-yl]-4,6-diphenyl-1,3,5-triazine;2-[5-[4-(4,6-diphenyl-2-pyridinyl)phenyl]naphthalen-2-yl]-4,6-diphenyl-1,3,5-triazine
CID 159163792
2-[3-[4-(2,6-diphenylpyrimidin-4-yl)phenyl]phenyl]-4,6-diphenyl-1,3,5-triazine;2-[3-[4-(2,6-diphenylpyrimidin-4-yl)phenyl]phenyl]-4-naphthalen-1-yl-6-phenyl-1,3,5-triazine;bis(2-[3-[4-(2,6-diphenylpyrimidin-4-yl)phenyl]phenyl]-4-naphthalen-2-yl-6-phenyl-1,3,5-triazine);2-[3-[4-(6-naphthalen-2-yl-2-phenylpyrimidin-4-yl)phenyl]phenyl]-4,6-diphenyl-1,3,5-triazine
CID 163499320
2-[3-[8-[3-(4,6-diphenyl-2-pyridinyl)phenyl]naphthalen-1-yl]phenyl]-4,6-diphenylpyridine;4-[3-[8-[3-(2,6-diphenyl-4-pyridinyl)phenyl]naphthalen-1-yl]phenyl]-2,6-diphenylpyridine;2-[3-[8-[3-(4,6-diphenylpyrimidin-2-yl)phenyl]naphthalen-1-yl]phenyl]-4,6-diphenylpyrimidine;4-[3-[7-[3-(2,6-diphenylpyrimidin-4-yl)phenyl]naphthalen-1-yl]phenyl]-2,6-diphenylpyrimidine;2-[8-(4,6-diphenyl-1,3,5-triazin-2-yl)naphthalen-1-yl]-4,6-diphenyl-1,3,5-triazine;2-naphthalen-2-yl-4-[8-(4-naphthalen-2-yl-6-phenyl-1,3,5-triazin-2-yl)naphthalen-1-yl]-6-phenyl-1,3,5-triazine
CID 158790011
2-[3-(2,6-diphenyl-4-pyridinyl)-5-(4,6-diphenylpyrimidin-2-yl)phenyl]-4,6-diphenylpyrimidine;4-[3-(4,6-diphenyl-2-pyridinyl)-5-(2-naphthalen-2-yl-6-phenylpyrimidin-4-yl)phenyl]-2-naphthalen-2-yl-6-phenylpyrimidine;4-[3-(4,6-diphenyl-2-pyridinyl)-5-(6-naphthalen-2-yl-2-phenylpyrimidin-4-yl)phenyl]-6-naphthalen-2-yl-2-phenylpyrimidine
CID 158243119

Frequently Asked Questions

What is the IUPAC name of 2,4-dinaphthalen-2-yl-6-phenanthren-2-yl-1,3,5-triazine;2-naphthalen-2-yl-4-phenanthren-2-yl-6-phenyl-1,3,5-triazine;2-phenanthren-2-yl-4,6-diphenylpyridine;2-phenanthren-2-yl-4,6-diphenylpyrimidine;2-phenanthren-2-yl-4,6-diphenyl-1,3,5-triazine;5-[2-[7-(4-quinolin-5-yl-2-pyridinyl)phenanthren-2-yl]-4-pyridinyl]quinoline?
The IUPAC name of 2,4-dinaphthalen-2-yl-6-phenanthren-2-yl-1,3,5-triazine;2-naphthalen-2-yl-4-phenanthren-2-yl-6-phenyl-1,3,5-triazine;2-phenanthren-2-yl-4,6-diphenylpyridine;2-phenanthren-2-yl-4,6-diphenylpyrimidine;2-phenanthren-2-yl-4,6-diphenyl-1,3,5-triazine;5-[2-[7-(4-quinolin-5-yl-2-pyridinyl)phenanthren-2-yl]-4-pyridinyl]quinoline (CID 158449062) is 2,4-dinaphthalen-2-yl-6-phenanthren-2-yl-1,3,5-triazine;2-naphthalen-2-yl-4-phenanthren-2-yl-6-phenyl-1,3,5-triazine;2-phenanthren-2-yl-4,6-diphenylpyridine;2-phenanthren-2-yl-4,6-diphenylpyrimidine;2-phenanthren-2-yl-4,6-diphenyl-1,3,5-triazine;5-[2-[7-(4-quinolin-5-yl-2-pyridinyl)phenanthren-2-yl]-4-pyridinyl]quinoline.
What is the SMILES notation for 2,4-dinaphthalen-2-yl-6-phenanthren-2-yl-1,3,5-triazine;2-naphthalen-2-yl-4-phenanthren-2-yl-6-phenyl-1,3,5-triazine;2-phenanthren-2-yl-4,6-diphenylpyridine;2-phenanthren-2-yl-4,6-diphenylpyrimidine;2-phenanthren-2-yl-4,6-diphenyl-1,3,5-triazine;5-[2-[7-(4-quinolin-5-yl-2-pyridinyl)phenanthren-2-yl]-4-pyridinyl]quinoline?
The canonical SMILES for 2,4-dinaphthalen-2-yl-6-phenanthren-2-yl-1,3,5-triazine;2-naphthalen-2-yl-4-phenanthren-2-yl-6-phenyl-1,3,5-triazine;2-phenanthren-2-yl-4,6-diphenylpyridine;2-phenanthren-2-yl-4,6-diphenylpyrimidine;2-phenanthren-2-yl-4,6-diphenyl-1,3,5-triazine;5-[2-[7-(4-quinolin-5-yl-2-pyridinyl)phenanthren-2-yl]-4-pyridinyl]quinoline is c1cc(-c2ccnc(-c3ccc4c(ccc5cc(-c6cc(-c7cccc8ncccc78)ccn6)ccc54)c3)c2)c2cccnc2c1.c1ccc(-c2cc(-c3ccccc3)nc(-c3ccc4c(ccc5ccccc54)c3)c2)cc1.c1ccc(-c2cc(-c3ccccc3)nc(-c3ccc4c(ccc5ccccc54)c3)n2)cc1.c1ccc(-c2nc(-c3ccc4ccccc4c3)nc(-c3ccc4c(ccc5ccccc54)c3)n2)cc1.c1ccc(-c2nc(-c3ccccc3)nc(-c3ccc4c(ccc5ccccc54)c3)n2)cc1.c1ccc2cc(-c3nc(-c4ccc5ccccc5c4)nc(-c4ccc5c(ccc6ccccc65)c4)n3)ccc2c1.
What is the InChIKey of 2,4-dinaphthalen-2-yl-6-phenanthren-2-yl-1,3,5-triazine;2-naphthalen-2-yl-4-phenanthren-2-yl-6-phenyl-1,3,5-triazine;2-phenanthren-2-yl-4,6-diphenylpyridine;2-phenanthren-2-yl-4,6-diphenylpyrimidine;2-phenanthren-2-yl-4,6-diphenyl-1,3,5-triazine;5-[2-[7-(4-quinolin-5-yl-2-pyridinyl)phenanthren-2-yl]-4-pyridinyl]quinoline?
The InChIKey is HDTFYTOEPWVTJJ-UHFFFAOYSA-N. The full InChI is InChI=1S/C42H26N4.C37H23N3.C33H21N3.C31H21N.C30H20N2.C29H19N3/c1-5-33(37-7-3-19-43-39(37)9-1)29-17-21-45-41(25-29)31-13-15-35-27(23-31)11-12-28-24-32(14-16-36(28)35)42-26-30(18-22-46-42)34-6-2-10-40-38(34)8-4-20-44-40;1-3-10-27-21-30(17-13-24(27)7-1)35-38-36(31-18-14-25-8-2-4-11-28(25)22-31)40-37(39-35)32-19-20-34-29(23-32)16-15-26-9-5-6-12-33(26)34;1-2-10-24(11-3-1)31-34-32(27-17-14-22-8-4-5-12-25(22)20-27)36-33(35-31)28-18-19-30-26(21-28)16-15-23-9-6-7-13-29(23)30;1-3-9-22(10-4-1)27-20-30(24-12-5-2-6-13-24)32-31(21-27)26-17-18-29-25(19-26)16-15-23-11-7-8-14-28(23)29;1-3-10-22(11-4-1)28-20-29(23-12-5-2-6-13-23)32-30(31-28)25-17-18-27-24(19-25)16-15-21-9-7-8-14-26(21)27;1-3-10-21(11-4-1)27-30-28(22-12-5-2-6-13-22)32-29(31-27)24-17-18-26-23(19-24)16-15-20-9-7-8-14-25(20)26/h1-26H;1-23H;1-21H;1-21H;1-20H;1-19H.
What are the key properties of 2,4-dinaphthalen-2-yl-6-phenanthren-2-yl-1,3,5-triazine;2-naphthalen-2-yl-4-phenanthren-2-yl-6-phenyl-1,3,5-triazine;2-phenanthren-2-yl-4,6-diphenylpyridine;2-phenanthren-2-yl-4,6-diphenylpyrimidine;2-phenanthren-2-yl-4,6-diphenyl-1,3,5-triazine;5-[2-[7-(4-quinolin-5-yl-2-pyridinyl)phenanthren-2-yl]-4-pyridinyl]quinoline?
2,4-dinaphthalen-2-yl-6-phenanthren-2-yl-1,3,5-triazine;2-naphthalen-2-yl-4-phenanthren-2-yl-6-phenyl-1,3,5-triazine;2-phenanthren-2-yl-4,6-diphenylpyridine;2-phenanthren-2-yl-4,6-diphenylpyrimidine;2-phenanthren-2-yl-4,6-diphenyl-1,3,5-triazine;5-[2-[7-(4-quinolin-5-yl-2-pyridinyl)phenanthren-2-yl]-4-pyridinyl]quinoline has a molecular weight of 2781.37 g/mol, XLogP of 51.72, 19 rotatable bonds, 0 hydrogen bond donors, and 16 hydrogen bond acceptors.
Where does this data come from?
All data for 2,4-dinaphthalen-2-yl-6-phenanthren-2-yl-1,3,5-triazine;2-naphthalen-2-yl-4-phenanthren-2-yl-6-phenyl-1,3,5-triazine;2-phenanthren-2-yl-4,6-diphenylpyridine;2-phenanthren-2-yl-4,6-diphenylpyrimidine;2-phenanthren-2-yl-4,6-diphenyl-1,3,5-triazine;5-[2-[7-(4-quinolin-5-yl-2-pyridinyl)phenanthren-2-yl]-4-pyridinyl]quinoline is sourced from PubChem (CID 158449062), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).