2-[1-(4-tert-butyl-2,5-diphenylphenyl)-4-[3-tert-butyl-5-[4-(4-methylphenyl)-2-pyridinyl]benzene-6-id-1-yl]benzimidazol-2-yl]phenol;2-[1-(4-tert-butyl-2,5-diphenylphenyl)-4-[3-tert-butyl-5-(4-phenyl-2-pyridinyl)benzene-6-id-1-yl]benzimidazol-2-yl]phenol;2-[1-[2-(4-tert-butylphenyl)-4-phenyl-5-(trideuteriomethyl)phenyl]-4-[3-phenyl-5-[3,5,6-trideuterio-4-[2,3,5,6-tetradeuterio-4-[1,1,1,3,3,3-hexadeuterio-2-(trideuteriomethyl)propan-2-yl]phenyl]-2-pyridinyl]benzene-6-id-1-yl]benzimidazol-2-yl]phenol;platinum

C176H152N9O3Pt3-3 — CID 157178189

About 2-[1-(4-tert-butyl-2,5-diphenylphenyl)-4-[3-tert-butyl-5-[4-(4-methylphenyl)-2-pyridinyl]benzene-6-id-1-yl]benzimidazol-2-yl]phenol;2-[1-(4-tert-butyl-2,5-diphenylphenyl)-4-[3-tert-butyl-5-(4-phenyl-2-pyridinyl)benzene-6-id-1-yl]benzimidazol-2-yl]phenol;2-[1-[2-(4-tert-butylphenyl)-4-phenyl-5-(trideuteriomethyl)phenyl]-4-[3-phenyl-5-[3,5,6-trideuterio-4-[2,3,5,6-tetradeuterio-4-[1,1,1,3,3,3-hexadeuterio-2-(trideuteriomethyl)propan-2-yl]phenyl]-2-pyridinyl]benzene-6-id-1-yl]benzimidazol-2-yl]phenol;platinum

2-[1-(4-tert-butyl-2,5-diphenylphenyl)-4-[3-tert-butyl-5-[4-(4-methylphenyl)-2-pyridinyl]benzene-6-id-1-yl]benzimidazol-2-yl]phenol;2-[1-(4-tert-butyl-2,5-diphenylphenyl)-4-[3-tert-butyl-5-(4-phenyl-2-pyridinyl)benzene-6-id-1-yl]benzimidazol-2-yl]phenol;2-[1-[2-(4-tert-butylphenyl)-4-phenyl-5-(trideuteriomethyl)phenyl]-4-[3-phenyl-5-[3,5,6-trideuterio-4-[2,3,5,6-tetradeuterio-4-[1,1,1,3,3,3-hexadeuterio-2-(trideuteriomethyl)propan-2-yl]phenyl]-2-pyridinyl]benzene-6-id-1-yl]benzimidazol-2-yl]phenol;platinum (PubChem CID 157178189) has the molecular formula C176H152N9O3Pt3-3 and a molecular weight of 3045.56 g/mol. Its IUPAC name is 2-[1-(4-tert-butyl-2,5-diphenylphenyl)-4-[3-tert-butyl-5-[4-(4-methylphenyl)-2-pyridinyl]benzene-6-id-1-yl]benzimidazol-2-yl]phenol;2-[1-(4-tert-butyl-2,5-diphenylphenyl)-4-[3-tert-butyl-5-(4-phenyl-2-pyridinyl)benzene-6-id-1-yl]benzimidazol-2-yl]phenol;2-[1-[2-(4-tert-butylphenyl)-4-phenyl-5-(trideuteriomethyl)phenyl]-4-[3-phenyl-5-[3,5,6-trideuterio-4-[2,3,5,6-tetradeuterio-4-[1,1,1,3,3,3-hexadeuterio-2-(trideuteriomethyl)propan-2-yl]phenyl]-2-pyridinyl]benzene-6-id-1-yl]benzimidazol-2-yl]phenol;platinum.

Molecular Properties

• Compound Name: 2-[1-(4-tert-butyl-2,5-diphenylphenyl)-4-[3-tert-butyl-5-[4-(4-methylphenyl)-2-pyridinyl]benzene-6-id-1-yl]benzimidazol-2-yl]phenol;2-[1-(4-tert-butyl-2,5-diphenylphenyl)-4-[3-tert-butyl-5-(4-phenyl-2-pyridinyl)benzene-6-id-1-yl]benzimidazol-2-yl]phenol;2-[1-[2-(4-tert-butylphenyl)-4-phenyl-5-(trideuteriomethyl)phenyl]-4-[3-phenyl-5-[3,5,6-trideuterio-4-[2,3,5,6-tetradeuterio-4-[1,1,1,3,3,3-hexadeuterio-2-(trideuteriomethyl)propan-2-yl]phenyl]-2-pyridinyl]benzene-6-id-1-yl]benzimidazol-2-yl]phenol;platinum
• PubChem CID: 157178189
• Molecular Formula: C176H152N9O3Pt3-3
• Molecular Weight: 3045.56 g/mol
• Exact Mass: 3043.22
• IUPAC Name: 2-[1-(4-tert-butyl-2,5-diphenylphenyl)-4-[3-tert-butyl-5-[4-(4-methylphenyl)-2-pyridinyl]benzene-6-id-1-yl]benzimidazol-2-yl]phenol;2-[1-(4-tert-butyl-2,5-diphenylphenyl)-4-[3-tert-butyl-5-(4-phenyl-2-pyridinyl)benzene-6-id-1-yl]benzimidazol-2-yl]phenol;2-[1-[2-(4-tert-butylphenyl)-4-phenyl-5-(trideuteriomethyl)phenyl]-4-[3-phenyl-5-[3,5,6-trideuterio-4-[2,3,5,6-tetradeuterio-4-[1,1,1,3,3,3-hexadeuterio-2-(trideuteriomethyl)propan-2-yl]phenyl]-2-pyridinyl]benzene-6-id-1-yl]benzimidazol-2-yl]phenol;platinum
• SMILES: CC(C)(C)c1cc(-c2cc(-c3ccccc3)ccn2)[c-]c(-c2cccc3c2nc(-c2ccccc2O)n3-c2cc(-c3ccccc3)c(C(C)(C)C)cc2-c2ccccc2)c1.Cc1ccc(-c2ccnc(-c3[c-]c(-c4cccc5c4nc(-c4ccccc4O)n5-c4cc(-c5ccccc5)c(C(C)(C)C)cc4-c4ccccc4)cc(C(C)(C)C)c3)c2)cc1.[2H]c1nc(-c2[c-]c(-c3cccc4c3nc(-c3ccccc3O)n4-c3cc(C([2H])([2H])[2H])c(-c4ccccc4)cc3-c3ccc(C(C)(C)C)cc3)cc(-c3ccccc3)c2)c([2H])c(-c2c([2H])c([2H])c(C(C([2H])([2H])[2H])(C([2H])([2H])[2H])C([2H])([2H])[2H])c([2H])c2[2H])c1[2H].[Pt].[Pt].[Pt]
• InChI: InChI=1S/C63H54N3O.C57H50N3O.C56H48N3O.3Pt/c1-41-35-58(55(40-54(41)44-19-12-9-13-20-44)45-27-31-51(32-28-45)63(5,6)7)66-57-23-16-22-52(60(57)65-61(66)53-21-14-15-24-59(53)67)48-36-47(42-17-10-8-11-18-42)37-49(38-48)56-39-46(33-34-64-56)43-25-29-50(30-26-43)62(2,3)4;1-37-25-27-38(28-26-37)41-29-30-58-50(34-41)43-31-42(32-44(33-43)56(2,3)4)45-22-16-23-51-54(45)59-55(46-21-14-15-24-53(46)61)60(51)52-36-47(39-17-10-8-11-18-39)49(57(5,6)7)35-48(52)40-19-12-9-13-20-40;1-55(2,3)43-32-41(31-42(33-43)49-34-40(29-30-57-49)37-19-10-7-11-20-37)44-26-18-27-50-53(44)58-54(45-25-16-17-28-52(45)60)59(50)51-36-46(38-21-12-8-13-22-38)48(56(4,5)6)35-47(51)39-23-14-9-15-24-39;;;/h8-37,39-40,67H,1-7H3;8-30,32-36,61H,1-7H3;7-30,32-36,60H,1-6H3;;;/q3*-1;;;/i1D3,2D3,3D3,4D3,25D,26D,29D,30D,33D,34D,39D
• InChIKey: YRZTUDBGOORZAZ-MTBHDKRTSA-N
• XLogP: 45.85
• TPSA: 152.82 Ų
• H-Bond Donors: 3
• H-Bond Acceptors: 12
• Rotatable Bonds: 23
• Heavy Atoms: 191
• Complexity: —

Lipinski Rule of Five

3 violations

Rule	Value
MW ≤ 500	3045.56
LogP ≤ 5	45.85
H-Bond Donors ≤ 5	3
H-Bond Acceptors ≤ 10	12

Computed Properties (RDKit)

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

Frequently Asked Questions

What is the IUPAC name of 2-[1-(4-tert-butyl-2,5-diphenylphenyl)-4-[3-tert-butyl-5-[4-(4-methylphenyl)-2-pyridinyl]benzene-6-id-1-yl]benzimidazol-2-yl]phenol;2-[1-(4-tert-butyl-2,5-diphenylphenyl)-4-[3-tert-butyl-5-(4-phenyl-2-pyridinyl)benzene-6-id-1-yl]benzimidazol-2-yl]phenol;2-[1-[2-(4-tert-butylphenyl)-4-phenyl-5-(trideuteriomethyl)phenyl]-4-[3-phenyl-5-[3,5,6-trideuterio-4-[2,3,5,6-tetradeuterio-4-[1,1,1,3,3,3-hexadeuterio-2-(trideuteriomethyl)propan-2-yl]phenyl]-2-pyridinyl]benzene-6-id-1-yl]benzimidazol-2-yl]phenol;platinum?

The IUPAC name of 2-[1-(4-tert-butyl-2,5-diphenylphenyl)-4-[3-tert-butyl-5-[4-(4-methylphenyl)-2-pyridinyl]benzene-6-id-1-yl]benzimidazol-2-yl]phenol;2-[1-(4-tert-butyl-2,5-diphenylphenyl)-4-[3-tert-butyl-5-(4-phenyl-2-pyridinyl)benzene-6-id-1-yl]benzimidazol-2-yl]phenol;2-[1-[2-(4-tert-butylphenyl)-4-phenyl-5-(trideuteriomethyl)phenyl]-4-[3-phenyl-5-[3,5,6-trideuterio-4-[2,3,5,6-tetradeuterio-4-[1,1,1,3,3,3-hexadeuterio-2-(trideuteriomethyl)propan-2-yl]phenyl]-2-pyridinyl]benzene-6-id-1-yl]benzimidazol-2-yl]phenol;platinum (CID 157178189) is 2-[1-(4-tert-butyl-2,5-diphenylphenyl)-4-[3-tert-butyl-5-[4-(4-methylphenyl)-2-pyridinyl]benzene-6-id-1-yl]benzimidazol-2-yl]phenol;2-[1-(4-tert-butyl-2,5-diphenylphenyl)-4-[3-tert-butyl-5-(4-phenyl-2-pyridinyl)benzene-6-id-1-yl]benzimidazol-2-yl]phenol;2-[1-[2-(4-tert-butylphenyl)-4-phenyl-5-(trideuteriomethyl)phenyl]-4-[3-phenyl-5-[3,5,6-trideuterio-4-[2,3,5,6-tetradeuterio-4-[1,1,1,3,3,3-hexadeuterio-2-(trideuteriomethyl)propan-2-yl]phenyl]-2-pyridinyl]benzene-6-id-1-yl]benzimidazol-2-yl]phenol;platinum.

What is the SMILES notation for 2-[1-(4-tert-butyl-2,5-diphenylphenyl)-4-[3-tert-butyl-5-[4-(4-methylphenyl)-2-pyridinyl]benzene-6-id-1-yl]benzimidazol-2-yl]phenol;2-[1-(4-tert-butyl-2,5-diphenylphenyl)-4-[3-tert-butyl-5-(4-phenyl-2-pyridinyl)benzene-6-id-1-yl]benzimidazol-2-yl]phenol;2-[1-[2-(4-tert-butylphenyl)-4-phenyl-5-(trideuteriomethyl)phenyl]-4-[3-phenyl-5-[3,5,6-trideuterio-4-[2,3,5,6-tetradeuterio-4-[1,1,1,3,3,3-hexadeuterio-2-(trideuteriomethyl)propan-2-yl]phenyl]-2-pyridinyl]benzene-6-id-1-yl]benzimidazol-2-yl]phenol;platinum?

The canonical SMILES for 2-[1-(4-tert-butyl-2,5-diphenylphenyl)-4-[3-tert-butyl-5-[4-(4-methylphenyl)-2-pyridinyl]benzene-6-id-1-yl]benzimidazol-2-yl]phenol;2-[1-(4-tert-butyl-2,5-diphenylphenyl)-4-[3-tert-butyl-5-(4-phenyl-2-pyridinyl)benzene-6-id-1-yl]benzimidazol-2-yl]phenol;2-[1-[2-(4-tert-butylphenyl)-4-phenyl-5-(trideuteriomethyl)phenyl]-4-[3-phenyl-5-[3,5,6-trideuterio-4-[2,3,5,6-tetradeuterio-4-[1,1,1,3,3,3-hexadeuterio-2-(trideuteriomethyl)propan-2-yl]phenyl]-2-pyridinyl]benzene-6-id-1-yl]benzimidazol-2-yl]phenol;platinum is CC(C)(C)c1cc(-c2cc(-c3ccccc3)ccn2)[c-]c(-c2cccc3c2nc(-c2ccccc2O)n3-c2cc(-c3ccccc3)c(C(C)(C)C)cc2-c2ccccc2)c1.Cc1ccc(-c2ccnc(-c3[c-]c(-c4cccc5c4nc(-c4ccccc4O)n5-c4cc(-c5ccccc5)c(C(C)(C)C)cc4-c4ccccc4)cc(C(C)(C)C)c3)c2)cc1.[2H]c1nc(-c2[c-]c(-c3cccc4c3nc(-c3ccccc3O)n4-c3cc(C([2H])([2H])[2H])c(-c4ccccc4)cc3-c3ccc(C(C)(C)C)cc3)cc(-c3ccccc3)c2)c([2H])c(-c2c([2H])c([2H])c(C(C([2H])([2H])[2H])(C([2H])([2H])[2H])C([2H])([2H])[2H])c([2H])c2[2H])c1[2H].[Pt].[Pt].[Pt].

What is the InChIKey of 2-[1-(4-tert-butyl-2,5-diphenylphenyl)-4-[3-tert-butyl-5-[4-(4-methylphenyl)-2-pyridinyl]benzene-6-id-1-yl]benzimidazol-2-yl]phenol;2-[1-(4-tert-butyl-2,5-diphenylphenyl)-4-[3-tert-butyl-5-(4-phenyl-2-pyridinyl)benzene-6-id-1-yl]benzimidazol-2-yl]phenol;2-[1-[2-(4-tert-butylphenyl)-4-phenyl-5-(trideuteriomethyl)phenyl]-4-[3-phenyl-5-[3,5,6-trideuterio-4-[2,3,5,6-tetradeuterio-4-[1,1,1,3,3,3-hexadeuterio-2-(trideuteriomethyl)propan-2-yl]phenyl]-2-pyridinyl]benzene-6-id-1-yl]benzimidazol-2-yl]phenol;platinum?

The InChIKey is YRZTUDBGOORZAZ-MTBHDKRTSA-N. The full InChI is InChI=1S/C63H54N3O.C57H50N3O.C56H48N3O.3Pt/c1-41-35-58(55(40-54(41)44-19-12-9-13-20-44)45-27-31-51(32-28-45)63(5,6)7)66-57-23-16-22-52(60(57)65-61(66)53-21-14-15-24-59(53)67)48-36-47(42-17-10-8-11-18-42)37-49(38-48)56-39-46(33-34-64-56)43-25-29-50(30-26-43)62(2,3)4;1-37-25-27-38(28-26-37)41-29-30-58-50(34-41)43-31-42(32-44(33-43)56(2,3)4)45-22-16-23-51-54(45)59-55(46-21-14-15-24-53(46)61)60(51)52-36-47(39-17-10-8-11-18-39)49(57(5,6)7)35-48(52)40-19-12-9-13-20-40;1-55(2,3)43-32-41(31-42(33-43)49-34-40(29-30-57-49)37-19-10-7-11-20-37)44-26-18-27-50-53(44)58-54(45-25-16-17-28-52(45)60)59(50)51-36-46(38-21-12-8-13-22-38)48(56(4,5)6)35-47(51)39-23-14-9-15-24-39;;;/h8-37,39-40,67H,1-7H3;8-30,32-36,61H,1-7H3;7-30,32-36,60H,1-6H3;;;/q3*-1;;;/i1D3,2D3,3D3,4D3,25D,26D,29D,30D,33D,34D,39D;;;;;.

What are the key properties of 2-[1-(4-tert-butyl-2,5-diphenylphenyl)-4-[3-tert-butyl-5-[4-(4-methylphenyl)-2-pyridinyl]benzene-6-id-1-yl]benzimidazol-2-yl]phenol;2-[1-(4-tert-butyl-2,5-diphenylphenyl)-4-[3-tert-butyl-5-(4-phenyl-2-pyridinyl)benzene-6-id-1-yl]benzimidazol-2-yl]phenol;2-[1-[2-(4-tert-butylphenyl)-4-phenyl-5-(trideuteriomethyl)phenyl]-4-[3-phenyl-5-[3,5,6-trideuterio-4-[2,3,5,6-tetradeuterio-4-[1,1,1,3,3,3-hexadeuterio-2-(trideuteriomethyl)propan-2-yl]phenyl]-2-pyridinyl]benzene-6-id-1-yl]benzimidazol-2-yl]phenol;platinum?

2-[1-(4-tert-butyl-2,5-diphenylphenyl)-4-[3-tert-butyl-5-[4-(4-methylphenyl)-2-pyridinyl]benzene-6-id-1-yl]benzimidazol-2-yl]phenol;2-[1-(4-tert-butyl-2,5-diphenylphenyl)-4-[3-tert-butyl-5-(4-phenyl-2-pyridinyl)benzene-6-id-1-yl]benzimidazol-2-yl]phenol;2-[1-[2-(4-tert-butylphenyl)-4-phenyl-5-(trideuteriomethyl)phenyl]-4-[3-phenyl-5-[3,5,6-trideuterio-4-[2,3,5,6-tetradeuterio-4-[1,1,1,3,3,3-hexadeuterio-2-(trideuteriomethyl)propan-2-yl]phenyl]-2-pyridinyl]benzene-6-id-1-yl]benzimidazol-2-yl]phenol;platinum has a molecular weight of 3045.56 g/mol, XLogP of 45.85, 23 rotatable bonds, 3 hydrogen bond donors, and 12 hydrogen bond acceptors.

Where does this data come from?

All data for 2-[1-(4-tert-butyl-2,5-diphenylphenyl)-4-[3-tert-butyl-5-[4-(4-methylphenyl)-2-pyridinyl]benzene-6-id-1-yl]benzimidazol-2-yl]phenol;2-[1-(4-tert-butyl-2,5-diphenylphenyl)-4-[3-tert-butyl-5-(4-phenyl-2-pyridinyl)benzene-6-id-1-yl]benzimidazol-2-yl]phenol;2-[1-[2-(4-tert-butylphenyl)-4-phenyl-5-(trideuteriomethyl)phenyl]-4-[3-phenyl-5-[3,5,6-trideuterio-4-[2,3,5,6-tetradeuterio-4-[1,1,1,3,3,3-hexadeuterio-2-(trideuteriomethyl)propan-2-yl]phenyl]-2-pyridinyl]benzene-6-id-1-yl]benzimidazol-2-yl]phenol;platinum is sourced from PubChem (CID 157178189), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).