2,4-bis(4-tert-butylphenyl)-6-[6-(4-fluorobenzene-6-id-1-yl)-3-pyridinyl]-1,3,5-triazine;4-[5-[4,6-bis(4-tert-butylphenyl)-1,3,5-triazin-2-yl]-2-pyridinyl]benzene-5-ide-1-carbonitrile;2,4-bis(4-tert-butylphenyl)-6-[6-[4-(trifluoromethyl)benzene-6-id-1-yl]-3-pyridinyl]-1,3,5-triazine;2,4-bis(6-butyl-3-pyridinyl)-6-(6-phenyl-3-pyridinyl)-1,3,5-triazine;2,4-bis(2-methylpyrimidin-5-yl)-6-(6-phenyl-3-pyridinyl)-1,3,5-triazine;2,4-bis(5-methylpyrimidin-2-yl)-6-(6-phenyl-3-pyridinyl)-1,3,5-triazine;hexakis(iridium)

C184H161F4Ir6N35-6 — CID 157385460

About 2,4-bis(4-tert-butylphenyl)-6-[6-(4-fluorobenzene-6-id-1-yl)-3-pyridinyl]-1,3,5-triazine;4-[5-[4,6-bis(4-tert-butylphenyl)-1,3,5-triazin-2-yl]-2-pyridinyl]benzene-5-ide-1-carbonitrile;2,4-bis(4-tert-butylphenyl)-6-[6-[4-(trifluoromethyl)benzene-6-id-1-yl]-3-pyridinyl]-1,3,5-triazine;2,4-bis(6-butyl-3-pyridinyl)-6-(6-phenyl-3-pyridinyl)-1,3,5-triazine;2,4-bis(2-methylpyrimidin-5-yl)-6-(6-phenyl-3-pyridinyl)-1,3,5-triazine;2,4-bis(5-methylpyrimidin-2-yl)-6-(6-phenyl-3-pyridinyl)-1,3,5-triazine;hexakis(iridium)

2,4-bis(4-tert-butylphenyl)-6-[6-(4-fluorobenzene-6-id-1-yl)-3-pyridinyl]-1,3,5-triazine;4-[5-[4,6-bis(4-tert-butylphenyl)-1,3,5-triazin-2-yl]-2-pyridinyl]benzene-5-ide-1-carbonitrile;2,4-bis(4-tert-butylphenyl)-6-[6-[4-(trifluoromethyl)benzene-6-id-1-yl]-3-pyridinyl]-1,3,5-triazine;2,4-bis(6-butyl-3-pyridinyl)-6-(6-phenyl-3-pyridinyl)-1,3,5-triazine;2,4-bis(2-methylpyrimidin-5-yl)-6-(6-phenyl-3-pyridinyl)-1,3,5-triazine;2,4-bis(5-methylpyrimidin-2-yl)-6-(6-phenyl-3-pyridinyl)-1,3,5-triazine;hexakis(iridium) (PubChem CID 157385460) has the molecular formula C184H161F4Ir6N35-6 and a molecular weight of 4091.85 g/mol. Its IUPAC name is 2,4-bis(4-tert-butylphenyl)-6-[6-(4-fluorobenzene-6-id-1-yl)-3-pyridinyl]-1,3,5-triazine;4-[5-[4,6-bis(4-tert-butylphenyl)-1,3,5-triazin-2-yl]-2-pyridinyl]benzene-5-ide-1-carbonitrile;2,4-bis(4-tert-butylphenyl)-6-[6-[4-(trifluoromethyl)benzene-6-id-1-yl]-3-pyridinyl]-1,3,5-triazine;2,4-bis(6-butyl-3-pyridinyl)-6-(6-phenyl-3-pyridinyl)-1,3,5-triazine;2,4-bis(2-methylpyrimidin-5-yl)-6-(6-phenyl-3-pyridinyl)-1,3,5-triazine;2,4-bis(5-methylpyrimidin-2-yl)-6-(6-phenyl-3-pyridinyl)-1,3,5-triazine;hexakis(iridium).

Molecular Properties

• Compound Name: 2,4-bis(4-tert-butylphenyl)-6-[6-(4-fluorobenzene-6-id-1-yl)-3-pyridinyl]-1,3,5-triazine;4-[5-[4,6-bis(4-tert-butylphenyl)-1,3,5-triazin-2-yl]-2-pyridinyl]benzene-5-ide-1-carbonitrile;2,4-bis(4-tert-butylphenyl)-6-[6-[4-(trifluoromethyl)benzene-6-id-1-yl]-3-pyridinyl]-1,3,5-triazine;2,4-bis(6-butyl-3-pyridinyl)-6-(6-phenyl-3-pyridinyl)-1,3,5-triazine;2,4-bis(2-methylpyrimidin-5-yl)-6-(6-phenyl-3-pyridinyl)-1,3,5-triazine;2,4-bis(5-methylpyrimidin-2-yl)-6-(6-phenyl-3-pyridinyl)-1,3,5-triazine;hexakis(iridium)
• PubChem CID: 157385460
• Molecular Formula: C184H161F4Ir6N35-6
• Molecular Weight: 4091.85 g/mol
• Exact Mass: 4094.14
• IUPAC Name: 2,4-bis(4-tert-butylphenyl)-6-[6-(4-fluorobenzene-6-id-1-yl)-3-pyridinyl]-1,3,5-triazine;4-[5-[4,6-bis(4-tert-butylphenyl)-1,3,5-triazin-2-yl]-2-pyridinyl]benzene-5-ide-1-carbonitrile;2,4-bis(4-tert-butylphenyl)-6-[6-[4-(trifluoromethyl)benzene-6-id-1-yl]-3-pyridinyl]-1,3,5-triazine;2,4-bis(6-butyl-3-pyridinyl)-6-(6-phenyl-3-pyridinyl)-1,3,5-triazine;2,4-bis(2-methylpyrimidin-5-yl)-6-(6-phenyl-3-pyridinyl)-1,3,5-triazine;2,4-bis(5-methylpyrimidin-2-yl)-6-(6-phenyl-3-pyridinyl)-1,3,5-triazine;hexakis(iridium)
• SMILES: CC(C)(C)c1ccc(-c2nc(-c3ccc(C(C)(C)C)cc3)nc(-c3ccc(-c4[c-]cc(C#N)cc4)nc3)n2)cc1.CC(C)(C)c1ccc(-c2nc(-c3ccc(C(C)(C)C)cc3)nc(-c3ccc(-c4[c-]cc(C(F)(F)F)cc4)nc3)n2)cc1.CC(C)(C)c1ccc(-c2nc(-c3ccc(C(C)(C)C)cc3)nc(-c3ccc(-c4[c-]cc(F)cc4)nc3)n2)cc1.CCCCc1ccc(-c2nc(-c3ccc(CCCC)nc3)nc(-c3ccc(-c4[c-]cccc4)nc3)n2)cn1.Cc1cnc(-c2nc(-c3ccc(-c4[c-]cccc4)nc3)nc(-c3ncc(C)cn3)n2)nc1.Cc1ncc(-c2nc(-c3ccc(-c4[c-]cccc4)nc3)nc(-c3cnc(C)nc3)n2)cn1.[Ir].[Ir].[Ir].[Ir].[Ir].[Ir]
• InChI: InChI=1S/C35H32F3N4.C35H32N5.C34H32FN4.C32H31N6.2C24H17N8.6Ir/c1-33(2,3)26-14-9-23(10-15-26)30-40-31(24-11-16-27(17-12-24)34(4,5)6)42-32(41-30)25-13-20-29(39-21-25)22-7-18-28(19-8-22)35(36,37)38;1-34(2,3)28-16-11-25(12-17-28)31-38-32(26-13-18-29(19-14-26)35(4,5)6)40-33(39-31)27-15-20-30(37-22-27)24-9-7-23(21-36)8-10-24;1-33(2,3)26-14-7-23(8-15-26)30-37-31(24-9-16-27(17-10-24)34(4,5)6)39-32(38-30)25-13-20-29(36-21-25)22-11-18-28(35)19-12-22;1-3-5-12-27-17-14-24(20-33-27)30-36-31(25-15-18-28(34-21-25)13-6-4-2)38-32(37-30)26-16-19-29(35-22-26)23-10-8-7-9-11-23;1-15-25-11-19(12-26-15)23-30-22(31-24(32-23)20-13-27-16(2)28-14-20)18-8-9-21(29-10-18)17-6-4-3-5-7-17;1-15-10-26-21(27-11-15)23-30-20(31-24(32-23)22-28-12-16(2)13-29-22)18-8-9-19(25-14-18)17-6-4-3-5-7-17;;;;;;/h7,9-21H,1-6H3;7-9,11-20,22H,1-6H3;7-11,13-21H,1-6H3;7-10,14-22H,3-6,12-13H2,1-2H3;2*3-6,8-14H,1-2H3;;;;;;/q6*-1
• InChIKey: DJORHAOIJQZSAD-UHFFFAOYSA-N
• XLogP: 41.08
• TPSA: 462.05 Ų
• H-Bond Acceptors: 35
• Rotatable Bonds: 30
• Heavy Atoms: 229
• Complexity: —

Lipinski Rule of Five

3 violations

Rule	Value
MW ≤ 500	4091.85
LogP ≤ 5	41.08
H-Bond Donors ≤ 5	0
H-Bond Acceptors ≤ 10	35

Computed Properties (RDKit)

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

Frequently Asked Questions

What is the IUPAC name of 2,4-bis(4-tert-butylphenyl)-6-[6-(4-fluorobenzene-6-id-1-yl)-3-pyridinyl]-1,3,5-triazine;4-[5-[4,6-bis(4-tert-butylphenyl)-1,3,5-triazin-2-yl]-2-pyridinyl]benzene-5-ide-1-carbonitrile;2,4-bis(4-tert-butylphenyl)-6-[6-[4-(trifluoromethyl)benzene-6-id-1-yl]-3-pyridinyl]-1,3,5-triazine;2,4-bis(6-butyl-3-pyridinyl)-6-(6-phenyl-3-pyridinyl)-1,3,5-triazine;2,4-bis(2-methylpyrimidin-5-yl)-6-(6-phenyl-3-pyridinyl)-1,3,5-triazine;2,4-bis(5-methylpyrimidin-2-yl)-6-(6-phenyl-3-pyridinyl)-1,3,5-triazine;hexakis(iridium)?

The IUPAC name of 2,4-bis(4-tert-butylphenyl)-6-[6-(4-fluorobenzene-6-id-1-yl)-3-pyridinyl]-1,3,5-triazine;4-[5-[4,6-bis(4-tert-butylphenyl)-1,3,5-triazin-2-yl]-2-pyridinyl]benzene-5-ide-1-carbonitrile;2,4-bis(4-tert-butylphenyl)-6-[6-[4-(trifluoromethyl)benzene-6-id-1-yl]-3-pyridinyl]-1,3,5-triazine;2,4-bis(6-butyl-3-pyridinyl)-6-(6-phenyl-3-pyridinyl)-1,3,5-triazine;2,4-bis(2-methylpyrimidin-5-yl)-6-(6-phenyl-3-pyridinyl)-1,3,5-triazine;2,4-bis(5-methylpyrimidin-2-yl)-6-(6-phenyl-3-pyridinyl)-1,3,5-triazine;hexakis(iridium) (CID 157385460) is 2,4-bis(4-tert-butylphenyl)-6-[6-(4-fluorobenzene-6-id-1-yl)-3-pyridinyl]-1,3,5-triazine;4-[5-[4,6-bis(4-tert-butylphenyl)-1,3,5-triazin-2-yl]-2-pyridinyl]benzene-5-ide-1-carbonitrile;2,4-bis(4-tert-butylphenyl)-6-[6-[4-(trifluoromethyl)benzene-6-id-1-yl]-3-pyridinyl]-1,3,5-triazine;2,4-bis(6-butyl-3-pyridinyl)-6-(6-phenyl-3-pyridinyl)-1,3,5-triazine;2,4-bis(2-methylpyrimidin-5-yl)-6-(6-phenyl-3-pyridinyl)-1,3,5-triazine;2,4-bis(5-methylpyrimidin-2-yl)-6-(6-phenyl-3-pyridinyl)-1,3,5-triazine;hexakis(iridium).

What is the SMILES notation for 2,4-bis(4-tert-butylphenyl)-6-[6-(4-fluorobenzene-6-id-1-yl)-3-pyridinyl]-1,3,5-triazine;4-[5-[4,6-bis(4-tert-butylphenyl)-1,3,5-triazin-2-yl]-2-pyridinyl]benzene-5-ide-1-carbonitrile;2,4-bis(4-tert-butylphenyl)-6-[6-[4-(trifluoromethyl)benzene-6-id-1-yl]-3-pyridinyl]-1,3,5-triazine;2,4-bis(6-butyl-3-pyridinyl)-6-(6-phenyl-3-pyridinyl)-1,3,5-triazine;2,4-bis(2-methylpyrimidin-5-yl)-6-(6-phenyl-3-pyridinyl)-1,3,5-triazine;2,4-bis(5-methylpyrimidin-2-yl)-6-(6-phenyl-3-pyridinyl)-1,3,5-triazine;hexakis(iridium)?

The canonical SMILES for 2,4-bis(4-tert-butylphenyl)-6-[6-(4-fluorobenzene-6-id-1-yl)-3-pyridinyl]-1,3,5-triazine;4-[5-[4,6-bis(4-tert-butylphenyl)-1,3,5-triazin-2-yl]-2-pyridinyl]benzene-5-ide-1-carbonitrile;2,4-bis(4-tert-butylphenyl)-6-[6-[4-(trifluoromethyl)benzene-6-id-1-yl]-3-pyridinyl]-1,3,5-triazine;2,4-bis(6-butyl-3-pyridinyl)-6-(6-phenyl-3-pyridinyl)-1,3,5-triazine;2,4-bis(2-methylpyrimidin-5-yl)-6-(6-phenyl-3-pyridinyl)-1,3,5-triazine;2,4-bis(5-methylpyrimidin-2-yl)-6-(6-phenyl-3-pyridinyl)-1,3,5-triazine;hexakis(iridium) is CC(C)(C)c1ccc(-c2nc(-c3ccc(C(C)(C)C)cc3)nc(-c3ccc(-c4[c-]cc(C#N)cc4)nc3)n2)cc1.CC(C)(C)c1ccc(-c2nc(-c3ccc(C(C)(C)C)cc3)nc(-c3ccc(-c4[c-]cc(C(F)(F)F)cc4)nc3)n2)cc1.CC(C)(C)c1ccc(-c2nc(-c3ccc(C(C)(C)C)cc3)nc(-c3ccc(-c4[c-]cc(F)cc4)nc3)n2)cc1.CCCCc1ccc(-c2nc(-c3ccc(CCCC)nc3)nc(-c3ccc(-c4[c-]cccc4)nc3)n2)cn1.Cc1cnc(-c2nc(-c3ccc(-c4[c-]cccc4)nc3)nc(-c3ncc(C)cn3)n2)nc1.Cc1ncc(-c2nc(-c3ccc(-c4[c-]cccc4)nc3)nc(-c3cnc(C)nc3)n2)cn1.[Ir].[Ir].[Ir].[Ir].[Ir].[Ir].

What is the InChIKey of 2,4-bis(4-tert-butylphenyl)-6-[6-(4-fluorobenzene-6-id-1-yl)-3-pyridinyl]-1,3,5-triazine;4-[5-[4,6-bis(4-tert-butylphenyl)-1,3,5-triazin-2-yl]-2-pyridinyl]benzene-5-ide-1-carbonitrile;2,4-bis(4-tert-butylphenyl)-6-[6-[4-(trifluoromethyl)benzene-6-id-1-yl]-3-pyridinyl]-1,3,5-triazine;2,4-bis(6-butyl-3-pyridinyl)-6-(6-phenyl-3-pyridinyl)-1,3,5-triazine;2,4-bis(2-methylpyrimidin-5-yl)-6-(6-phenyl-3-pyridinyl)-1,3,5-triazine;2,4-bis(5-methylpyrimidin-2-yl)-6-(6-phenyl-3-pyridinyl)-1,3,5-triazine;hexakis(iridium)?

The InChIKey is DJORHAOIJQZSAD-UHFFFAOYSA-N. The full InChI is InChI=1S/C35H32F3N4.C35H32N5.C34H32FN4.C32H31N6.2C24H17N8.6Ir/c1-33(2,3)26-14-9-23(10-15-26)30-40-31(24-11-16-27(17-12-24)34(4,5)6)42-32(41-30)25-13-20-29(39-21-25)22-7-18-28(19-8-22)35(36,37)38;1-34(2,3)28-16-11-25(12-17-28)31-38-32(26-13-18-29(19-14-26)35(4,5)6)40-33(39-31)27-15-20-30(37-22-27)24-9-7-23(21-36)8-10-24;1-33(2,3)26-14-7-23(8-15-26)30-37-31(24-9-16-27(17-10-24)34(4,5)6)39-32(38-30)25-13-20-29(36-21-25)22-11-18-28(35)19-12-22;1-3-5-12-27-17-14-24(20-33-27)30-36-31(25-15-18-28(34-21-25)13-6-4-2)38-32(37-30)26-16-19-29(35-22-26)23-10-8-7-9-11-23;1-15-25-11-19(12-26-15)23-30-22(31-24(32-23)20-13-27-16(2)28-14-20)18-8-9-21(29-10-18)17-6-4-3-5-7-17;1-15-10-26-21(27-11-15)23-30-20(31-24(32-23)22-28-12-16(2)13-29-22)18-8-9-19(25-14-18)17-6-4-3-5-7-17;;;;;;/h7,9-21H,1-6H3;7-9,11-20,22H,1-6H3;7-11,13-21H,1-6H3;7-10,14-22H,3-6,12-13H2,1-2H3;2*3-6,8-14H,1-2H3;;;;;;/q6*-1;;;;;;.

What are the key properties of 2,4-bis(4-tert-butylphenyl)-6-[6-(4-fluorobenzene-6-id-1-yl)-3-pyridinyl]-1,3,5-triazine;4-[5-[4,6-bis(4-tert-butylphenyl)-1,3,5-triazin-2-yl]-2-pyridinyl]benzene-5-ide-1-carbonitrile;2,4-bis(4-tert-butylphenyl)-6-[6-[4-(trifluoromethyl)benzene-6-id-1-yl]-3-pyridinyl]-1,3,5-triazine;2,4-bis(6-butyl-3-pyridinyl)-6-(6-phenyl-3-pyridinyl)-1,3,5-triazine;2,4-bis(2-methylpyrimidin-5-yl)-6-(6-phenyl-3-pyridinyl)-1,3,5-triazine;2,4-bis(5-methylpyrimidin-2-yl)-6-(6-phenyl-3-pyridinyl)-1,3,5-triazine;hexakis(iridium)?

2,4-bis(4-tert-butylphenyl)-6-[6-(4-fluorobenzene-6-id-1-yl)-3-pyridinyl]-1,3,5-triazine;4-[5-[4,6-bis(4-tert-butylphenyl)-1,3,5-triazin-2-yl]-2-pyridinyl]benzene-5-ide-1-carbonitrile;2,4-bis(4-tert-butylphenyl)-6-[6-[4-(trifluoromethyl)benzene-6-id-1-yl]-3-pyridinyl]-1,3,5-triazine;2,4-bis(6-butyl-3-pyridinyl)-6-(6-phenyl-3-pyridinyl)-1,3,5-triazine;2,4-bis(2-methylpyrimidin-5-yl)-6-(6-phenyl-3-pyridinyl)-1,3,5-triazine;2,4-bis(5-methylpyrimidin-2-yl)-6-(6-phenyl-3-pyridinyl)-1,3,5-triazine;hexakis(iridium) has a molecular weight of 4091.85 g/mol, XLogP of 41.08, 30 rotatable bonds, 0 hydrogen bond donors, and 35 hydrogen bond acceptors.

Where does this data come from?

All data for 2,4-bis(4-tert-butylphenyl)-6-[6-(4-fluorobenzene-6-id-1-yl)-3-pyridinyl]-1,3,5-triazine;4-[5-[4,6-bis(4-tert-butylphenyl)-1,3,5-triazin-2-yl]-2-pyridinyl]benzene-5-ide-1-carbonitrile;2,4-bis(4-tert-butylphenyl)-6-[6-[4-(trifluoromethyl)benzene-6-id-1-yl]-3-pyridinyl]-1,3,5-triazine;2,4-bis(6-butyl-3-pyridinyl)-6-(6-phenyl-3-pyridinyl)-1,3,5-triazine;2,4-bis(2-methylpyrimidin-5-yl)-6-(6-phenyl-3-pyridinyl)-1,3,5-triazine;2,4-bis(5-methylpyrimidin-2-yl)-6-(6-phenyl-3-pyridinyl)-1,3,5-triazine;hexakis(iridium) is sourced from PubChem (CID 157385460), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).