2,4-bis[4-(9,9-dimethylfluoren-2-yl)phenyl]-6-phenyl-1,3,5-triazine;8-[4-(4,6-dinaphthalen-2-yl-1,3,5-triazin-2-yl)phenyl]quinoline;8-[4-[4-(4-naphthalen-1-ylphenyl)-6-(4-phenylphenyl)-1,3,5-triazin-2-yl]phenyl]quinoline;3-[4-[4-phenanthren-9-yl-6-(4-phenanthren-9-ylphenyl)-1,3,5-triazin-2-yl]phenyl]quinoline

C187H125N15 — CID 165041588

About 2,4-bis[4-(9,9-dimethylfluoren-2-yl)phenyl]-6-phenyl-1,3,5-triazine;8-[4-(4,6-dinaphthalen-2-yl-1,3,5-triazin-2-yl)phenyl]quinoline;8-[4-[4-(4-naphthalen-1-ylphenyl)-6-(4-phenylphenyl)-1,3,5-triazin-2-yl]phenyl]quinoline;3-[4-[4-phenanthren-9-yl-6-(4-phenanthren-9-ylphenyl)-1,3,5-triazin-2-yl]phenyl]quinoline

2,4-bis[4-(9,9-dimethylfluoren-2-yl)phenyl]-6-phenyl-1,3,5-triazine;8-[4-(4,6-dinaphthalen-2-yl-1,3,5-triazin-2-yl)phenyl]quinoline;8-[4-[4-(4-naphthalen-1-ylphenyl)-6-(4-phenylphenyl)-1,3,5-triazin-2-yl]phenyl]quinoline;3-[4-[4-phenanthren-9-yl-6-(4-phenanthren-9-ylphenyl)-1,3,5-triazin-2-yl]phenyl]quinoline (PubChem CID 165041588) has the molecular formula C187H125N15 and a molecular weight of 2582.16 g/mol. Its IUPAC name is 2,4-bis[4-(9,9-dimethylfluoren-2-yl)phenyl]-6-phenyl-1,3,5-triazine;8-[4-(4,6-dinaphthalen-2-yl-1,3,5-triazin-2-yl)phenyl]quinoline;8-[4-[4-(4-naphthalen-1-ylphenyl)-6-(4-phenylphenyl)-1,3,5-triazin-2-yl]phenyl]quinoline;3-[4-[4-phenanthren-9-yl-6-(4-phenanthren-9-ylphenyl)-1,3,5-triazin-2-yl]phenyl]quinoline.

Molecular Properties

• Compound Name: 2,4-bis[4-(9,9-dimethylfluoren-2-yl)phenyl]-6-phenyl-1,3,5-triazine;8-[4-(4,6-dinaphthalen-2-yl-1,3,5-triazin-2-yl)phenyl]quinoline;8-[4-[4-(4-naphthalen-1-ylphenyl)-6-(4-phenylphenyl)-1,3,5-triazin-2-yl]phenyl]quinoline;3-[4-[4-phenanthren-9-yl-6-(4-phenanthren-9-ylphenyl)-1,3,5-triazin-2-yl]phenyl]quinoline
• PubChem CID: 165041588
• Molecular Formula: C187H125N15
• Molecular Weight: 2582.16 g/mol
• Exact Mass: 2580.02
• IUPAC Name: 2,4-bis[4-(9,9-dimethylfluoren-2-yl)phenyl]-6-phenyl-1,3,5-triazine;8-[4-(4,6-dinaphthalen-2-yl-1,3,5-triazin-2-yl)phenyl]quinoline;8-[4-[4-(4-naphthalen-1-ylphenyl)-6-(4-phenylphenyl)-1,3,5-triazin-2-yl]phenyl]quinoline;3-[4-[4-phenanthren-9-yl-6-(4-phenanthren-9-ylphenyl)-1,3,5-triazin-2-yl]phenyl]quinoline
• SMILES: CC1(C)c2ccccc2-c2ccc(-c3ccc(-c4nc(-c5ccccc5)nc(-c5ccc(-c6ccc7c(c6)C(C)(C)c6ccccc6-7)cc5)n4)cc3)cc21.c1ccc(-c2ccc(-c3nc(-c4ccc(-c5cccc6ccccc56)cc4)nc(-c4ccc(-c5cccc6cccnc56)cc4)n3)cc2)cc1.c1ccc2cc(-c3nc(-c4ccc(-c5cccc6cccnc56)cc4)nc(-c4ccc5ccccc5c4)n3)ccc2c1.c1ccc2ncc(-c3ccc(-c4nc(-c5ccc(-c6cc7ccccc7c7ccccc67)cc5)nc(-c5cc6ccccc6c6ccccc56)n4)cc3)cc2c1
• InChI: InChI=1S/C52H32N4.C51H39N3.C46H30N4.C38H24N4/c1-4-14-41-37(11-1)30-47(45-18-8-6-16-43(41)45)34-23-27-36(28-24-34)51-54-50(35-25-21-33(22-26-35)40-29-39-13-3-10-20-49(39)53-32-40)55-52(56-51)48-31-38-12-2-5-15-42(38)44-17-7-9-19-46(44)48;1-50(2)43-16-10-8-14-39(43)41-28-26-37(30-45(41)50)32-18-22-35(23-19-32)48-52-47(34-12-6-5-7-13-34)53-49(54-48)36-24-20-33(21-25-36)38-27-29-42-40-15-9-11-17-44(40)51(3,4)46(42)31-38;1-2-9-31(10-3-1)32-18-24-37(25-19-32)44-48-45(38-26-20-34(21-27-38)41-16-6-12-33-11-4-5-15-40(33)41)50-46(49-44)39-28-22-35(23-29-39)42-17-7-13-36-14-8-30-47-43(36)42;1-3-9-30-23-32(20-14-25(30)7-1)37-40-36(41-38(42-37)33-21-15-26-8-2-4-10-31(26)24-33)29-18-16-27(17-19-29)34-13-5-11-28-12-6-22-39-35(28)34/h1-32H;5-31H,1-4H3;1-30H;1-24H
• InChIKey: OFGDRZCESIXOKP-UHFFFAOYSA-N
• XLogP: 47.16
• TPSA: 193.35 Ų
• H-Bond Acceptors: 15
• Rotatable Bonds: 20
• Heavy Atoms: 202
• Complexity: —

Lipinski Rule of Five

3 violations

Rule	Value
MW ≤ 500	2582.16
LogP ≤ 5	47.16
H-Bond Donors ≤ 5	0
H-Bond Acceptors ≤ 10	15

Computed Properties (RDKit)

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

Frequently Asked Questions

What is the IUPAC name of 2,4-bis[4-(9,9-dimethylfluoren-2-yl)phenyl]-6-phenyl-1,3,5-triazine;8-[4-(4,6-dinaphthalen-2-yl-1,3,5-triazin-2-yl)phenyl]quinoline;8-[4-[4-(4-naphthalen-1-ylphenyl)-6-(4-phenylphenyl)-1,3,5-triazin-2-yl]phenyl]quinoline;3-[4-[4-phenanthren-9-yl-6-(4-phenanthren-9-ylphenyl)-1,3,5-triazin-2-yl]phenyl]quinoline?

The IUPAC name of 2,4-bis[4-(9,9-dimethylfluoren-2-yl)phenyl]-6-phenyl-1,3,5-triazine;8-[4-(4,6-dinaphthalen-2-yl-1,3,5-triazin-2-yl)phenyl]quinoline;8-[4-[4-(4-naphthalen-1-ylphenyl)-6-(4-phenylphenyl)-1,3,5-triazin-2-yl]phenyl]quinoline;3-[4-[4-phenanthren-9-yl-6-(4-phenanthren-9-ylphenyl)-1,3,5-triazin-2-yl]phenyl]quinoline (CID 165041588) is 2,4-bis[4-(9,9-dimethylfluoren-2-yl)phenyl]-6-phenyl-1,3,5-triazine;8-[4-(4,6-dinaphthalen-2-yl-1,3,5-triazin-2-yl)phenyl]quinoline;8-[4-[4-(4-naphthalen-1-ylphenyl)-6-(4-phenylphenyl)-1,3,5-triazin-2-yl]phenyl]quinoline;3-[4-[4-phenanthren-9-yl-6-(4-phenanthren-9-ylphenyl)-1,3,5-triazin-2-yl]phenyl]quinoline.

What is the SMILES notation for 2,4-bis[4-(9,9-dimethylfluoren-2-yl)phenyl]-6-phenyl-1,3,5-triazine;8-[4-(4,6-dinaphthalen-2-yl-1,3,5-triazin-2-yl)phenyl]quinoline;8-[4-[4-(4-naphthalen-1-ylphenyl)-6-(4-phenylphenyl)-1,3,5-triazin-2-yl]phenyl]quinoline;3-[4-[4-phenanthren-9-yl-6-(4-phenanthren-9-ylphenyl)-1,3,5-triazin-2-yl]phenyl]quinoline?

The canonical SMILES for 2,4-bis[4-(9,9-dimethylfluoren-2-yl)phenyl]-6-phenyl-1,3,5-triazine;8-[4-(4,6-dinaphthalen-2-yl-1,3,5-triazin-2-yl)phenyl]quinoline;8-[4-[4-(4-naphthalen-1-ylphenyl)-6-(4-phenylphenyl)-1,3,5-triazin-2-yl]phenyl]quinoline;3-[4-[4-phenanthren-9-yl-6-(4-phenanthren-9-ylphenyl)-1,3,5-triazin-2-yl]phenyl]quinoline is CC1(C)c2ccccc2-c2ccc(-c3ccc(-c4nc(-c5ccccc5)nc(-c5ccc(-c6ccc7c(c6)C(C)(C)c6ccccc6-7)cc5)n4)cc3)cc21.c1ccc(-c2ccc(-c3nc(-c4ccc(-c5cccc6ccccc56)cc4)nc(-c4ccc(-c5cccc6cccnc56)cc4)n3)cc2)cc1.c1ccc2cc(-c3nc(-c4ccc(-c5cccc6cccnc56)cc4)nc(-c4ccc5ccccc5c4)n3)ccc2c1.c1ccc2ncc(-c3ccc(-c4nc(-c5ccc(-c6cc7ccccc7c7ccccc67)cc5)nc(-c5cc6ccccc6c6ccccc56)n4)cc3)cc2c1.

What is the InChIKey of 2,4-bis[4-(9,9-dimethylfluoren-2-yl)phenyl]-6-phenyl-1,3,5-triazine;8-[4-(4,6-dinaphthalen-2-yl-1,3,5-triazin-2-yl)phenyl]quinoline;8-[4-[4-(4-naphthalen-1-ylphenyl)-6-(4-phenylphenyl)-1,3,5-triazin-2-yl]phenyl]quinoline;3-[4-[4-phenanthren-9-yl-6-(4-phenanthren-9-ylphenyl)-1,3,5-triazin-2-yl]phenyl]quinoline?

The InChIKey is OFGDRZCESIXOKP-UHFFFAOYSA-N. The full InChI is InChI=1S/C52H32N4.C51H39N3.C46H30N4.C38H24N4/c1-4-14-41-37(11-1)30-47(45-18-8-6-16-43(41)45)34-23-27-36(28-24-34)51-54-50(35-25-21-33(22-26-35)40-29-39-13-3-10-20-49(39)53-32-40)55-52(56-51)48-31-38-12-2-5-15-42(38)44-17-7-9-19-46(44)48;1-50(2)43-16-10-8-14-39(43)41-28-26-37(30-45(41)50)32-18-22-35(23-19-32)48-52-47(34-12-6-5-7-13-34)53-49(54-48)36-24-20-33(21-25-36)38-27-29-42-40-15-9-11-17-44(40)51(3,4)46(42)31-38;1-2-9-31(10-3-1)32-18-24-37(25-19-32)44-48-45(38-26-20-34(21-27-38)41-16-6-12-33-11-4-5-15-40(33)41)50-46(49-44)39-28-22-35(23-29-39)42-17-7-13-36-14-8-30-47-43(36)42;1-3-9-30-23-32(20-14-25(30)7-1)37-40-36(41-38(42-37)33-21-15-26-8-2-4-10-31(26)24-33)29-18-16-27(17-19-29)34-13-5-11-28-12-6-22-39-35(28)34/h1-32H;5-31H,1-4H3;1-30H;1-24H.

What are the key properties of 2,4-bis[4-(9,9-dimethylfluoren-2-yl)phenyl]-6-phenyl-1,3,5-triazine;8-[4-(4,6-dinaphthalen-2-yl-1,3,5-triazin-2-yl)phenyl]quinoline;8-[4-[4-(4-naphthalen-1-ylphenyl)-6-(4-phenylphenyl)-1,3,5-triazin-2-yl]phenyl]quinoline;3-[4-[4-phenanthren-9-yl-6-(4-phenanthren-9-ylphenyl)-1,3,5-triazin-2-yl]phenyl]quinoline?

2,4-bis[4-(9,9-dimethylfluoren-2-yl)phenyl]-6-phenyl-1,3,5-triazine;8-[4-(4,6-dinaphthalen-2-yl-1,3,5-triazin-2-yl)phenyl]quinoline;8-[4-[4-(4-naphthalen-1-ylphenyl)-6-(4-phenylphenyl)-1,3,5-triazin-2-yl]phenyl]quinoline;3-[4-[4-phenanthren-9-yl-6-(4-phenanthren-9-ylphenyl)-1,3,5-triazin-2-yl]phenyl]quinoline has a molecular weight of 2582.16 g/mol, XLogP of 47.16, 20 rotatable bonds, 0 hydrogen bond donors, and 15 hydrogen bond acceptors.

Where does this data come from?

All data for 2,4-bis[4-(9,9-dimethylfluoren-2-yl)phenyl]-6-phenyl-1,3,5-triazine;8-[4-(4,6-dinaphthalen-2-yl-1,3,5-triazin-2-yl)phenyl]quinoline;8-[4-[4-(4-naphthalen-1-ylphenyl)-6-(4-phenylphenyl)-1,3,5-triazin-2-yl]phenyl]quinoline;3-[4-[4-phenanthren-9-yl-6-(4-phenanthren-9-ylphenyl)-1,3,5-triazin-2-yl]phenyl]quinoline is sourced from PubChem (CID 165041588), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).