2,4-bis[3-[4-(6-methyl-2-pyridinyl)phenyl]-5-phenylphenyl]-6-(3-phenylphenyl)pyrimidine;2,4-bis[4-(6-methyl-3-pyridinyl)phenyl]-6-[3-(4-phenylphenyl)phenyl]-1,3,5-triazine;2-[4-(4,6-dimethylpyrimidin-2-yl)phenyl]-4,6-bis[4-(4-pyridin-2-ylphenyl)phenyl]-1,3,5-triazine;2-phenanthren-9-yl-4-phenyl-6-(3-pyridin-3-ylphenyl)-1,3,5-triazine

C192H136N20 — CID 165068322

About 2,4-bis[3-[4-(6-methyl-2-pyridinyl)phenyl]-5-phenylphenyl]-6-(3-phenylphenyl)pyrimidine;2,4-bis[4-(6-methyl-3-pyridinyl)phenyl]-6-[3-(4-phenylphenyl)phenyl]-1,3,5-triazine;2-[4-(4,6-dimethylpyrimidin-2-yl)phenyl]-4,6-bis[4-(4-pyridin-2-ylphenyl)phenyl]-1,3,5-triazine;2-phenanthren-9-yl-4-phenyl-6-(3-pyridin-3-ylphenyl)-1,3,5-triazine

2,4-bis[3-[4-(6-methyl-2-pyridinyl)phenyl]-5-phenylphenyl]-6-(3-phenylphenyl)pyrimidine;2,4-bis[4-(6-methyl-3-pyridinyl)phenyl]-6-[3-(4-phenylphenyl)phenyl]-1,3,5-triazine;2-[4-(4,6-dimethylpyrimidin-2-yl)phenyl]-4,6-bis[4-(4-pyridin-2-ylphenyl)phenyl]-1,3,5-triazine;2-phenanthren-9-yl-4-phenyl-6-(3-pyridin-3-ylphenyl)-1,3,5-triazine (PubChem CID 165068322) has the molecular formula C192H136N20 and a molecular weight of 2723.34 g/mol. Its IUPAC name is 2,4-bis[3-[4-(6-methyl-2-pyridinyl)phenyl]-5-phenylphenyl]-6-(3-phenylphenyl)pyrimidine;2,4-bis[4-(6-methyl-3-pyridinyl)phenyl]-6-[3-(4-phenylphenyl)phenyl]-1,3,5-triazine;2-[4-(4,6-dimethylpyrimidin-2-yl)phenyl]-4,6-bis[4-(4-pyridin-2-ylphenyl)phenyl]-1,3,5-triazine;2-phenanthren-9-yl-4-phenyl-6-(3-pyridin-3-ylphenyl)-1,3,5-triazine.

Molecular Properties

• Compound Name: 2,4-bis[3-[4-(6-methyl-2-pyridinyl)phenyl]-5-phenylphenyl]-6-(3-phenylphenyl)pyrimidine;2,4-bis[4-(6-methyl-3-pyridinyl)phenyl]-6-[3-(4-phenylphenyl)phenyl]-1,3,5-triazine;2-[4-(4,6-dimethylpyrimidin-2-yl)phenyl]-4,6-bis[4-(4-pyridin-2-ylphenyl)phenyl]-1,3,5-triazine;2-phenanthren-9-yl-4-phenyl-6-(3-pyridin-3-ylphenyl)-1,3,5-triazine
• PubChem CID: 165068322
• Molecular Formula: C192H136N20
• Molecular Weight: 2723.34 g/mol
• Exact Mass: 2721.13
• IUPAC Name: 2,4-bis[3-[4-(6-methyl-2-pyridinyl)phenyl]-5-phenylphenyl]-6-(3-phenylphenyl)pyrimidine;2,4-bis[4-(6-methyl-3-pyridinyl)phenyl]-6-[3-(4-phenylphenyl)phenyl]-1,3,5-triazine;2-[4-(4,6-dimethylpyrimidin-2-yl)phenyl]-4,6-bis[4-(4-pyridin-2-ylphenyl)phenyl]-1,3,5-triazine;2-phenanthren-9-yl-4-phenyl-6-(3-pyridin-3-ylphenyl)-1,3,5-triazine
• SMILES: Cc1cc(C)nc(-c2ccc(-c3nc(-c4ccc(-c5ccc(-c6ccccn6)cc5)cc4)nc(-c4ccc(-c5ccc(-c6ccccn6)cc5)cc4)n3)cc2)n1.Cc1ccc(-c2ccc(-c3nc(-c4ccc(-c5ccc(C)nc5)cc4)nc(-c4cccc(-c5ccc(-c6ccccc6)cc5)c4)n3)cc2)cn1.Cc1cccc(-c2ccc(-c3cc(-c4ccccc4)cc(-c4cc(-c5cccc(-c6ccccc6)c5)nc(-c5cc(-c6ccccc6)cc(-c6ccc(-c7cccc(C)n7)cc6)c5)n4)c3)cc2)n1.c1ccc(-c2nc(-c3cccc(-c4cccnc4)c3)nc(-c3cc4ccccc4c4ccccc34)n2)cc1
• InChI: InChI=1S/C64H46N4.C49H35N7.C45H33N5.C34H22N4/c1-43-15-12-25-60(65-43)50-31-27-48(28-32-50)55-36-54(46-19-8-4-9-20-46)38-58(39-55)63-42-62(53-24-14-23-52(35-53)45-17-6-3-7-18-45)67-64(68-63)59-40-56(47-21-10-5-11-22-47)37-57(41-59)49-29-33-51(34-30-49)61-26-13-16-44(2)66-61;1-32-31-33(2)53-46(52-32)40-25-27-43(28-26-40)49-55-47(41-21-13-36(14-22-41)34-9-17-38(18-10-34)44-7-3-5-29-50-44)54-48(56-49)42-23-15-37(16-24-42)35-11-19-39(20-12-35)45-8-4-6-30-51-45;1-30-11-13-41(28-46-30)35-19-23-37(24-20-35)43-48-44(38-25-21-36(22-26-38)42-14-12-31(2)47-29-42)50-45(49-43)40-10-6-9-39(27-40)34-17-15-33(16-18-34)32-7-4-3-5-8-32;1-2-10-23(11-3-1)32-36-33(26-14-8-13-24(20-26)27-15-9-19-35-22-27)38-34(37-32)31-21-25-12-4-5-16-28(25)29-17-6-7-18-30(29)31/h3-42H,1-2H3;3-31H,1-2H3;3-29H,1-2H3;1-22H
• InChIKey: SIILFDXDRNJOLB-UHFFFAOYSA-N
• XLogP: 47.15
• TPSA: 257.80 Ų
• H-Bond Acceptors: 20
• Rotatable Bonds: 29
• Heavy Atoms: 212
• Complexity: —

Lipinski Rule of Five

3 violations

Rule	Value
MW ≤ 500	2723.34
LogP ≤ 5	47.15
H-Bond Donors ≤ 5	0
H-Bond Acceptors ≤ 10	20

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[3-[4-(6-methyl-2-pyridinyl)phenyl]-5-phenylphenyl]-6-(3-phenylphenyl)pyrimidine;2,4-bis[4-(6-methyl-3-pyridinyl)phenyl]-6-[3-(4-phenylphenyl)phenyl]-1,3,5-triazine;2-[4-(4,6-dimethylpyrimidin-2-yl)phenyl]-4,6-bis[4-(4-pyridin-2-ylphenyl)phenyl]-1,3,5-triazine;2-phenanthren-9-yl-4-phenyl-6-(3-pyridin-3-ylphenyl)-1,3,5-triazine?

The IUPAC name of 2,4-bis[3-[4-(6-methyl-2-pyridinyl)phenyl]-5-phenylphenyl]-6-(3-phenylphenyl)pyrimidine;2,4-bis[4-(6-methyl-3-pyridinyl)phenyl]-6-[3-(4-phenylphenyl)phenyl]-1,3,5-triazine;2-[4-(4,6-dimethylpyrimidin-2-yl)phenyl]-4,6-bis[4-(4-pyridin-2-ylphenyl)phenyl]-1,3,5-triazine;2-phenanthren-9-yl-4-phenyl-6-(3-pyridin-3-ylphenyl)-1,3,5-triazine (CID 165068322) is 2,4-bis[3-[4-(6-methyl-2-pyridinyl)phenyl]-5-phenylphenyl]-6-(3-phenylphenyl)pyrimidine;2,4-bis[4-(6-methyl-3-pyridinyl)phenyl]-6-[3-(4-phenylphenyl)phenyl]-1,3,5-triazine;2-[4-(4,6-dimethylpyrimidin-2-yl)phenyl]-4,6-bis[4-(4-pyridin-2-ylphenyl)phenyl]-1,3,5-triazine;2-phenanthren-9-yl-4-phenyl-6-(3-pyridin-3-ylphenyl)-1,3,5-triazine.

What is the SMILES notation for 2,4-bis[3-[4-(6-methyl-2-pyridinyl)phenyl]-5-phenylphenyl]-6-(3-phenylphenyl)pyrimidine;2,4-bis[4-(6-methyl-3-pyridinyl)phenyl]-6-[3-(4-phenylphenyl)phenyl]-1,3,5-triazine;2-[4-(4,6-dimethylpyrimidin-2-yl)phenyl]-4,6-bis[4-(4-pyridin-2-ylphenyl)phenyl]-1,3,5-triazine;2-phenanthren-9-yl-4-phenyl-6-(3-pyridin-3-ylphenyl)-1,3,5-triazine?

The canonical SMILES for 2,4-bis[3-[4-(6-methyl-2-pyridinyl)phenyl]-5-phenylphenyl]-6-(3-phenylphenyl)pyrimidine;2,4-bis[4-(6-methyl-3-pyridinyl)phenyl]-6-[3-(4-phenylphenyl)phenyl]-1,3,5-triazine;2-[4-(4,6-dimethylpyrimidin-2-yl)phenyl]-4,6-bis[4-(4-pyridin-2-ylphenyl)phenyl]-1,3,5-triazine;2-phenanthren-9-yl-4-phenyl-6-(3-pyridin-3-ylphenyl)-1,3,5-triazine is Cc1cc(C)nc(-c2ccc(-c3nc(-c4ccc(-c5ccc(-c6ccccn6)cc5)cc4)nc(-c4ccc(-c5ccc(-c6ccccn6)cc5)cc4)n3)cc2)n1.Cc1ccc(-c2ccc(-c3nc(-c4ccc(-c5ccc(C)nc5)cc4)nc(-c4cccc(-c5ccc(-c6ccccc6)cc5)c4)n3)cc2)cn1.Cc1cccc(-c2ccc(-c3cc(-c4ccccc4)cc(-c4cc(-c5cccc(-c6ccccc6)c5)nc(-c5cc(-c6ccccc6)cc(-c6ccc(-c7cccc(C)n7)cc6)c5)n4)c3)cc2)n1.c1ccc(-c2nc(-c3cccc(-c4cccnc4)c3)nc(-c3cc4ccccc4c4ccccc34)n2)cc1.

What is the InChIKey of 2,4-bis[3-[4-(6-methyl-2-pyridinyl)phenyl]-5-phenylphenyl]-6-(3-phenylphenyl)pyrimidine;2,4-bis[4-(6-methyl-3-pyridinyl)phenyl]-6-[3-(4-phenylphenyl)phenyl]-1,3,5-triazine;2-[4-(4,6-dimethylpyrimidin-2-yl)phenyl]-4,6-bis[4-(4-pyridin-2-ylphenyl)phenyl]-1,3,5-triazine;2-phenanthren-9-yl-4-phenyl-6-(3-pyridin-3-ylphenyl)-1,3,5-triazine?

The InChIKey is SIILFDXDRNJOLB-UHFFFAOYSA-N. The full InChI is InChI=1S/C64H46N4.C49H35N7.C45H33N5.C34H22N4/c1-43-15-12-25-60(65-43)50-31-27-48(28-32-50)55-36-54(46-19-8-4-9-20-46)38-58(39-55)63-42-62(53-24-14-23-52(35-53)45-17-6-3-7-18-45)67-64(68-63)59-40-56(47-21-10-5-11-22-47)37-57(41-59)49-29-33-51(34-30-49)61-26-13-16-44(2)66-61;1-32-31-33(2)53-46(52-32)40-25-27-43(28-26-40)49-55-47(41-21-13-36(14-22-41)34-9-17-38(18-10-34)44-7-3-5-29-50-44)54-48(56-49)42-23-15-37(16-24-42)35-11-19-39(20-12-35)45-8-4-6-30-51-45;1-30-11-13-41(28-46-30)35-19-23-37(24-20-35)43-48-44(38-25-21-36(22-26-38)42-14-12-31(2)47-29-42)50-45(49-43)40-10-6-9-39(27-40)34-17-15-33(16-18-34)32-7-4-3-5-8-32;1-2-10-23(11-3-1)32-36-33(26-14-8-13-24(20-26)27-15-9-19-35-22-27)38-34(37-32)31-21-25-12-4-5-16-28(25)29-17-6-7-18-30(29)31/h3-42H,1-2H3;3-31H,1-2H3;3-29H,1-2H3;1-22H.

What are the key properties of 2,4-bis[3-[4-(6-methyl-2-pyridinyl)phenyl]-5-phenylphenyl]-6-(3-phenylphenyl)pyrimidine;2,4-bis[4-(6-methyl-3-pyridinyl)phenyl]-6-[3-(4-phenylphenyl)phenyl]-1,3,5-triazine;2-[4-(4,6-dimethylpyrimidin-2-yl)phenyl]-4,6-bis[4-(4-pyridin-2-ylphenyl)phenyl]-1,3,5-triazine;2-phenanthren-9-yl-4-phenyl-6-(3-pyridin-3-ylphenyl)-1,3,5-triazine?

2,4-bis[3-[4-(6-methyl-2-pyridinyl)phenyl]-5-phenylphenyl]-6-(3-phenylphenyl)pyrimidine;2,4-bis[4-(6-methyl-3-pyridinyl)phenyl]-6-[3-(4-phenylphenyl)phenyl]-1,3,5-triazine;2-[4-(4,6-dimethylpyrimidin-2-yl)phenyl]-4,6-bis[4-(4-pyridin-2-ylphenyl)phenyl]-1,3,5-triazine;2-phenanthren-9-yl-4-phenyl-6-(3-pyridin-3-ylphenyl)-1,3,5-triazine has a molecular weight of 2723.34 g/mol, XLogP of 47.15, 29 rotatable bonds, 0 hydrogen bond donors, and 20 hydrogen bond acceptors.

Where does this data come from?

All data for 2,4-bis[3-[4-(6-methyl-2-pyridinyl)phenyl]-5-phenylphenyl]-6-(3-phenylphenyl)pyrimidine;2,4-bis[4-(6-methyl-3-pyridinyl)phenyl]-6-[3-(4-phenylphenyl)phenyl]-1,3,5-triazine;2-[4-(4,6-dimethylpyrimidin-2-yl)phenyl]-4,6-bis[4-(4-pyridin-2-ylphenyl)phenyl]-1,3,5-triazine;2-phenanthren-9-yl-4-phenyl-6-(3-pyridin-3-ylphenyl)-1,3,5-triazine is sourced from PubChem (CID 165068322), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).