2-phenyl-4-pyren-1-yl-6-(2-pyridin-2-ylphenyl)-1,3,5-triazine;2-phenyl-4-pyren-1-yl-6-(2-pyridin-3-ylphenyl)-1,3,5-triazine;2-phenyl-4-pyren-1-yl-6-(3-pyridin-3-ylphenyl)-1,3,5-triazine;2-phenyl-4-pyren-1-yl-6-(3-pyridin-4-ylphenyl)-1,3,5-triazine

C144H88N16 — CID 158200788

IUPAC2-phenyl-4-pyren-1-yl-6-(2-pyridin-2-ylphenyl)-1,3,5-triazine;2-phenyl-4-pyren-1-yl-6-(2-pyridin-3-ylphenyl)-1,3,5-triazine;2-phenyl-4-pyren-1-yl-6-(3-pyridin-3-ylphenyl)-1,3,5-triazine;2-phenyl-4-pyren-1-yl-6-(3-pyridin-4-ylphenyl)-1,3,5-triazine
SMILESc1ccc(-c2nc(-c3cccc(-c4cccnc4)c3)nc(-c3ccc4ccc5cccc6ccc3c4c56)n2)cc1.c1ccc(-c2nc(-c3cccc(-c4ccncc4)c3)nc(-c3ccc4ccc5cccc6ccc3c4c56)n2)cc1.c1ccc(-c2nc(-c3ccccc3-c3ccccn3)nc(-c3ccc4ccc5cccc6ccc3c4c56)n2)cc1.c1ccc(-c2nc(-c3ccccc3-c3cccnc3)nc(-c3ccc4ccc5cccc6ccc3c4c56)n2)cc1
InChIInChI=1S/4C36H22N4/c1-2-7-26(8-3-1)34-38-35(28-12-5-11-27(21-28)29-13-6-20-37-22-29)40-36(39-34)31-19-17-25-15-14-23-9-4-10-24-16-18-30(31)33(25)32(23)24;1-2-6-27(7-3-1)34-38-35(29-11-5-10-28(22-29)23-18-20-37-21-19-23)40-36(39-34)31-17-15-26-13-12-24-8-4-9-25-14-16-30(31)33(26)32(24)25;1-2-8-26(9-3-1)34-38-35(30-14-5-4-13-28(30)27-12-7-21-37-22-27)40-36(39-34)31-20-18-25-16-15-23-10-6-11-24-17-19-29(31)33(25)32(23)24;1-2-9-26(10-3-1)34-38-35(29-14-5-4-13-27(29)31-15-6-7-22-37-31)40-36(39-34)30-21-19-25-17-16-23-11-8-12-24-18-20-28(30)33(25)32(23)24/h4*1-22H
InChIKeyGAXDJENJJWHGQW-UHFFFAOYSA-N
MW2042.40 g/mol
LogP35.33
Rot. Bonds16

About 2-phenyl-4-pyren-1-yl-6-(2-pyridin-2-ylphenyl)-1,3,5-triazine;2-phenyl-4-pyren-1-yl-6-(2-pyridin-3-ylphenyl)-1,3,5-triazine;2-phenyl-4-pyren-1-yl-6-(3-pyridin-3-ylphenyl)-1,3,5-triazine;2-phenyl-4-pyren-1-yl-6-(3-pyridin-4-ylphenyl)-1,3,5-triazine

2-phenyl-4-pyren-1-yl-6-(2-pyridin-2-ylphenyl)-1,3,5-triazine;2-phenyl-4-pyren-1-yl-6-(2-pyridin-3-ylphenyl)-1,3,5-triazine;2-phenyl-4-pyren-1-yl-6-(3-pyridin-3-ylphenyl)-1,3,5-triazine;2-phenyl-4-pyren-1-yl-6-(3-pyridin-4-ylphenyl)-1,3,5-triazine (PubChem CID 158200788) has the molecular formula C144H88N16 and a molecular weight of 2042.40 g/mol. Its IUPAC name is 2-phenyl-4-pyren-1-yl-6-(2-pyridin-2-ylphenyl)-1,3,5-triazine;2-phenyl-4-pyren-1-yl-6-(2-pyridin-3-ylphenyl)-1,3,5-triazine;2-phenyl-4-pyren-1-yl-6-(3-pyridin-3-ylphenyl)-1,3,5-triazine;2-phenyl-4-pyren-1-yl-6-(3-pyridin-4-ylphenyl)-1,3,5-triazine.

Molecular Properties

Compound Name2-phenyl-4-pyren-1-yl-6-(2-pyridin-2-ylphenyl)-1,3,5-triazine;2-phenyl-4-pyren-1-yl-6-(2-pyridin-3-ylphenyl)-1,3,5-triazine;2-phenyl-4-pyren-1-yl-6-(3-pyridin-3-ylphenyl)-1,3,5-triazine;2-phenyl-4-pyren-1-yl-6-(3-pyridin-4-ylphenyl)-1,3,5-triazine
PubChem CID158200788
Molecular FormulaC144H88N16
Molecular Weight2042.40 g/mol
Exact Mass2040.74
IUPAC Name2-phenyl-4-pyren-1-yl-6-(2-pyridin-2-ylphenyl)-1,3,5-triazine;2-phenyl-4-pyren-1-yl-6-(2-pyridin-3-ylphenyl)-1,3,5-triazine;2-phenyl-4-pyren-1-yl-6-(3-pyridin-3-ylphenyl)-1,3,5-triazine;2-phenyl-4-pyren-1-yl-6-(3-pyridin-4-ylphenyl)-1,3,5-triazine
SMILESc1ccc(-c2nc(-c3cccc(-c4cccnc4)c3)nc(-c3ccc4ccc5cccc6ccc3c4c56)n2)cc1.c1ccc(-c2nc(-c3cccc(-c4ccncc4)c3)nc(-c3ccc4ccc5cccc6ccc3c4c56)n2)cc1.c1ccc(-c2nc(-c3ccccc3-c3ccccn3)nc(-c3ccc4ccc5cccc6ccc3c4c56)n2)cc1.c1ccc(-c2nc(-c3ccccc3-c3cccnc3)nc(-c3ccc4ccc5cccc6ccc3c4c56)n2)cc1
InChIInChI=1S/4C36H22N4/c1-2-7-26(8-3-1)34-38-35(28-12-5-11-27(21-28)29-13-6-20-37-22-29)40-36(39-34)31-19-17-25-15-14-23-9-4-10-24-16-18-30(31)33(25)32(23)24;1-2-6-27(7-3-1)34-38-35(29-11-5-10-28(22-29)23-18-20-37-21-19-23)40-36(39-34)31-17-15-26-13-12-24-8-4-9-25-14-16-30(31)33(26)32(24)25;1-2-8-26(9-3-1)34-38-35(30-14-5-4-13-28(30)27-12-7-21-37-22-27)40-36(39-34)31-20-18-25-16-15-23-10-6-11-24-17-19-29(31)33(25)32(23)24;1-2-9-26(10-3-1)34-38-35(29-14-5-4-13-27(29)31-15-6-7-22-37-31)40-36(39-34)30-21-19-25-17-16-23-11-8-12-24-18-20-28(30)33(25)32(23)24/h4*1-22H
InChIKeyGAXDJENJJWHGQW-UHFFFAOYSA-N
XLogP35.33
TPSA206.24 Ų
H-Bond Donors
H-Bond Acceptors16
Rotatable Bonds16
Heavy Atoms160
Complexity—

Lipinski Rule of Five

3 violations

RuleValue
MW ≤ 5002042.40
LogP ≤ 535.33
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 1016

Computed Properties (RDKit)

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

Analyze 2-phenyl-4-pyren-1-yl-6-(2-pyridin-2-ylphenyl)-1,3,5-triazine;2-phenyl-4-pyren-1-yl-6-(2-pyridin-3-ylphenyl)-1,3,5-triazine;2-phenyl-4-pyren-1-yl-6-(3-pyridin-3-ylphenyl)-1,3,5-triazine;2-phenyl-4-pyren-1-yl-6-(3-pyridin-4-ylphenyl)-1,3,5-triazine with MolForge

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Related Compounds

5-[4-[6-[4,6-bis(4-pyridin-2-ylphenyl)-1,3,5-triazin-2-yl]pyren-1-yl]-6-quinolin-5-yl-1,3,5-triazin-2-yl]quinoline;5-[4-[6-[4,6-bis(4-pyridin-3-ylphenyl)-1,3,5-triazin-2-yl]pyren-1-yl]-6-quinolin-5-yl-1,3,5-triazin-2-yl]quinoline;5-[4-[6-[4,6-bis(4-pyridin-4-ylphenyl)-1,3,5-triazin-2-yl]pyren-1-yl]-6-quinolin-5-yl-1,3,5-triazin-2-yl]quinoline;5-[4-(5-phenyl-2-pyridinyl)-6-[6-[4-(4-pyridin-2-ylphenyl)-6-quinolin-5-yl-1,3,5-triazin-2-yl]pyren-1-yl]-1,3,5-triazin-2-yl]quinoline;5-[4-(3-pyridin-2-ylphenyl)-6-[6-[4-(3-pyridin-2-ylphenyl)-6-quinolin-5-yl-1,3,5-triazin-2-yl]pyren-1-yl]-1,3,5-triazin-2-yl]quinoline;5-[4-(3-pyridin-3-ylphenyl)-6-[6-[4-(3-pyridin-3-ylphenyl)-6-quinolin-5-yl-1,3,5-triazin-2-yl]pyren-1-yl]-1,3,5-triazin-2-yl]quinoline;5-[4-(3-pyridin-4-ylphenyl)-6-[6-[4-(3-pyridin-4-ylphenyl)-6-quinolin-5-yl-1,3,5-triazin-2-yl]pyren-1-yl]-1,3,5-triazin-2-yl]quinoline;5-[4-(4-pyridin-4-ylphenyl)-6-[6-[4-(4-pyridin-4-ylphenyl)-6-quinolin-5-yl-1,3,5-triazin-2-yl]pyren-1-yl]-1,3,5-triazin-2-yl]quinoline
CID 158617084
4-(4-fluorophenyl)-6-(4-pyren-1-ylphenyl)-2-(3-pyridin-3-ylphenyl)pyrimidine;4-(4-fluorophenyl)-6-(4-pyren-1-ylphenyl)-2-(4-pyridin-3-ylphenyl)pyrimidine;4-(4-fluorophenyl)-6-(4-pyren-1-ylphenyl)-2-(4-pyridin-4-ylphenyl)pyrimidine;4-(3-phenylphenyl)-6-(4-pyren-1-ylphenyl)-2-(2-pyridin-3-ylphenyl)pyrimidine
CID 161251604
2-(3-phenylphenyl)-4-(4-pyren-1-ylphenyl)-6-(4-pyridin-3-ylphenyl)pyrimidine;2-(3-phenylphenyl)-4-(4-pyren-1-ylphenyl)-6-(4-pyridin-4-ylphenyl)pyrimidine;4-[4-(4-pyren-1-ylphenyl)-6-(2-pyridin-3-ylphenyl)pyrimidin-2-yl]benzonitrile;4-[4-(4-pyren-1-ylphenyl)-6-(3-pyridin-3-ylphenyl)pyrimidin-2-yl]benzonitrile
CID 158049523
8-[4-(3-pyridin-3-ylphenyl)-6-[6-[4-(3-pyridin-3-ylphenyl)-6-quinolin-8-yl-1,3,5-triazin-2-yl]pyren-1-yl]-1,3,5-triazin-2-yl]quinoline
CID 146230726
2-(3-phenylphenyl)-4,6-bis(3-pyridin-3-ylphenyl)-1,3,5-triazine;2-(3-phenylphenyl)-4,6-bis(3-pyridin-4-ylphenyl)-1,3,5-triazine;2,4,6-tris(3-pyridin-2-ylphenyl)-1,3,5-triazine
CID 158115571
2-[4-(9,9-dimethylfluoren-2-yl)phenyl]-4-pyren-1-yl-6-(3-pyridin-3-ylphenyl)-1,3,5-triazine
CID 130264408
2-naphthalen-1-yl-4-[6-[4-naphthalen-1-yl-6-(3-pyridin-4-ylphenyl)-1,3,5-triazin-2-yl]pyren-1-yl]-6-(3-pyridin-4-ylphenyl)-1,3,5-triazine
CID 146230593
4-(4-phenylphenyl)-6-(4-pyren-1-ylphenyl)-2-(3-pyridin-3-ylphenyl)pyrimidine
CID 130263014
8-[4-[6-[4,6-bis(4-pyridin-3-ylphenyl)-1,3,5-triazin-2-yl]pyren-1-yl]-6-quinolin-8-yl-1,3,5-triazin-2-yl]quinoline
CID 146230730
2-(4-naphthalen-1-ylphenyl)-4-(4-pyren-1-ylphenyl)-6-(2-pyridin-3-ylphenyl)-1,3,5-triazine
CID 130264883
2,6-diphenyl-4-[3-phenyl-5-[3-[3-(3-phenylphenyl)phenyl]phenyl]phenyl]pyridine;4,6-diphenyl-2-[3-phenyl-5-[3-[3-(3-phenylphenyl)phenyl]phenyl]phenyl]pyrimidine;2,4-diphenyl-6-[3-phenyl-5-[3-[3-(3-phenylphenyl)phenyl]phenyl]phenyl]-1,3,5-triazine;2-phenyl-4,6-bis[2-[2-(4-phenylphenyl)phenyl]phenyl]pyrimidine;4-phenyl-2,6-bis[2-(4-phenylphenyl)phenyl]pyrimidine;4-phenyl-2,6-bis[2-[3-(3-pyridin-2-ylphenyl)phenyl]phenyl]pyrimidine;2-[3-phenyl-5-[3-[3-(3-phenylphenyl)phenyl]phenyl]phenyl]-4,6-dipyridin-4-yl-1,3,5-triazine;2-[3-[3-phenyl-5-[3-[3-(3-phenylphenyl)phenyl]phenyl]phenyl]-5-pyridin-3-ylphenyl]pyridine;3-[3-[3-phenyl-5-[3-[3-(3-phenylphenyl)phenyl]phenyl]phenyl]-5-pyridin-3-ylphenyl]pyridine;4-[3-[3-phenyl-5-[3-[3-(3-phenylphenyl)phenyl]phenyl]phenyl]-5-pyridin-4-ylphenyl]pyridine
CID 167658197
2-phenyl-4-pyridin-4-yl-6-triphenylen-2-yl-1,3,5-triazine;2-(3-pyridin-2-yl-5-triphenylen-2-ylphenyl)pyridine;2-(3-pyridin-3-yl-5-triphenylen-2-ylphenyl)pyridine;4-(3-pyridin-4-yl-5-triphenylen-2-ylphenyl)pyridine
CID 159367402

Frequently Asked Questions

What is the IUPAC name of 2-phenyl-4-pyren-1-yl-6-(2-pyridin-2-ylphenyl)-1,3,5-triazine;2-phenyl-4-pyren-1-yl-6-(2-pyridin-3-ylphenyl)-1,3,5-triazine;2-phenyl-4-pyren-1-yl-6-(3-pyridin-3-ylphenyl)-1,3,5-triazine;2-phenyl-4-pyren-1-yl-6-(3-pyridin-4-ylphenyl)-1,3,5-triazine?
The IUPAC name of 2-phenyl-4-pyren-1-yl-6-(2-pyridin-2-ylphenyl)-1,3,5-triazine;2-phenyl-4-pyren-1-yl-6-(2-pyridin-3-ylphenyl)-1,3,5-triazine;2-phenyl-4-pyren-1-yl-6-(3-pyridin-3-ylphenyl)-1,3,5-triazine;2-phenyl-4-pyren-1-yl-6-(3-pyridin-4-ylphenyl)-1,3,5-triazine (CID 158200788) is 2-phenyl-4-pyren-1-yl-6-(2-pyridin-2-ylphenyl)-1,3,5-triazine;2-phenyl-4-pyren-1-yl-6-(2-pyridin-3-ylphenyl)-1,3,5-triazine;2-phenyl-4-pyren-1-yl-6-(3-pyridin-3-ylphenyl)-1,3,5-triazine;2-phenyl-4-pyren-1-yl-6-(3-pyridin-4-ylphenyl)-1,3,5-triazine.
What is the SMILES notation for 2-phenyl-4-pyren-1-yl-6-(2-pyridin-2-ylphenyl)-1,3,5-triazine;2-phenyl-4-pyren-1-yl-6-(2-pyridin-3-ylphenyl)-1,3,5-triazine;2-phenyl-4-pyren-1-yl-6-(3-pyridin-3-ylphenyl)-1,3,5-triazine;2-phenyl-4-pyren-1-yl-6-(3-pyridin-4-ylphenyl)-1,3,5-triazine?
The canonical SMILES for 2-phenyl-4-pyren-1-yl-6-(2-pyridin-2-ylphenyl)-1,3,5-triazine;2-phenyl-4-pyren-1-yl-6-(2-pyridin-3-ylphenyl)-1,3,5-triazine;2-phenyl-4-pyren-1-yl-6-(3-pyridin-3-ylphenyl)-1,3,5-triazine;2-phenyl-4-pyren-1-yl-6-(3-pyridin-4-ylphenyl)-1,3,5-triazine is c1ccc(-c2nc(-c3cccc(-c4cccnc4)c3)nc(-c3ccc4ccc5cccc6ccc3c4c56)n2)cc1.c1ccc(-c2nc(-c3cccc(-c4ccncc4)c3)nc(-c3ccc4ccc5cccc6ccc3c4c56)n2)cc1.c1ccc(-c2nc(-c3ccccc3-c3ccccn3)nc(-c3ccc4ccc5cccc6ccc3c4c56)n2)cc1.c1ccc(-c2nc(-c3ccccc3-c3cccnc3)nc(-c3ccc4ccc5cccc6ccc3c4c56)n2)cc1.
What is the InChIKey of 2-phenyl-4-pyren-1-yl-6-(2-pyridin-2-ylphenyl)-1,3,5-triazine;2-phenyl-4-pyren-1-yl-6-(2-pyridin-3-ylphenyl)-1,3,5-triazine;2-phenyl-4-pyren-1-yl-6-(3-pyridin-3-ylphenyl)-1,3,5-triazine;2-phenyl-4-pyren-1-yl-6-(3-pyridin-4-ylphenyl)-1,3,5-triazine?
The InChIKey is GAXDJENJJWHGQW-UHFFFAOYSA-N. The full InChI is InChI=1S/4C36H22N4/c1-2-7-26(8-3-1)34-38-35(28-12-5-11-27(21-28)29-13-6-20-37-22-29)40-36(39-34)31-19-17-25-15-14-23-9-4-10-24-16-18-30(31)33(25)32(23)24;1-2-6-27(7-3-1)34-38-35(29-11-5-10-28(22-29)23-18-20-37-21-19-23)40-36(39-34)31-17-15-26-13-12-24-8-4-9-25-14-16-30(31)33(26)32(24)25;1-2-8-26(9-3-1)34-38-35(30-14-5-4-13-28(30)27-12-7-21-37-22-27)40-36(39-34)31-20-18-25-16-15-23-10-6-11-24-17-19-29(31)33(25)32(23)24;1-2-9-26(10-3-1)34-38-35(29-14-5-4-13-27(29)31-15-6-7-22-37-31)40-36(39-34)30-21-19-25-17-16-23-11-8-12-24-18-20-28(30)33(25)32(23)24/h4*1-22H.
What are the key properties of 2-phenyl-4-pyren-1-yl-6-(2-pyridin-2-ylphenyl)-1,3,5-triazine;2-phenyl-4-pyren-1-yl-6-(2-pyridin-3-ylphenyl)-1,3,5-triazine;2-phenyl-4-pyren-1-yl-6-(3-pyridin-3-ylphenyl)-1,3,5-triazine;2-phenyl-4-pyren-1-yl-6-(3-pyridin-4-ylphenyl)-1,3,5-triazine?
2-phenyl-4-pyren-1-yl-6-(2-pyridin-2-ylphenyl)-1,3,5-triazine;2-phenyl-4-pyren-1-yl-6-(2-pyridin-3-ylphenyl)-1,3,5-triazine;2-phenyl-4-pyren-1-yl-6-(3-pyridin-3-ylphenyl)-1,3,5-triazine;2-phenyl-4-pyren-1-yl-6-(3-pyridin-4-ylphenyl)-1,3,5-triazine has a molecular weight of 2042.40 g/mol, XLogP of 35.33, 16 rotatable bonds, 0 hydrogen bond donors, and 16 hydrogen bond acceptors.
Where does this data come from?
All data for 2-phenyl-4-pyren-1-yl-6-(2-pyridin-2-ylphenyl)-1,3,5-triazine;2-phenyl-4-pyren-1-yl-6-(2-pyridin-3-ylphenyl)-1,3,5-triazine;2-phenyl-4-pyren-1-yl-6-(3-pyridin-3-ylphenyl)-1,3,5-triazine;2-phenyl-4-pyren-1-yl-6-(3-pyridin-4-ylphenyl)-1,3,5-triazine is sourced from PubChem (CID 158200788), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).