2-tert-butyl-6-[4-[3-tert-butyl-5-(4-phenyl-2-pyridinyl)benzene-6-id-1-yl]-1-[4-[4-[1,1,1,3,3,3-hexadeuterio-2-(trideuteriomethyl)propan-2-yl]phenyl]-2-phenylphenyl]benzimidazol-2-yl]-4-methylphenol;platinum

C61H58N3OPt- — CID 167332555

About 2-tert-butyl-6-[4-[3-tert-butyl-5-(4-phenyl-2-pyridinyl)benzene-6-id-1-yl]-1-[4-[4-[1,1,1,3,3,3-hexadeuterio-2-(trideuteriomethyl)propan-2-yl]phenyl]-2-phenylphenyl]benzimidazol-2-yl]-4-methylphenol;platinum

2-tert-butyl-6-[4-[3-tert-butyl-5-(4-phenyl-2-pyridinyl)benzene-6-id-1-yl]-1-[4-[4-[1,1,1,3,3,3-hexadeuterio-2-(trideuteriomethyl)propan-2-yl]phenyl]-2-phenylphenyl]benzimidazol-2-yl]-4-methylphenol;platinum (PubChem CID 167332555) has the molecular formula C61H58N3OPt- and a molecular weight of 1053.29 g/mol. Its IUPAC name is 2-tert-butyl-6-[4-[3-tert-butyl-5-(4-phenyl-2-pyridinyl)benzene-6-id-1-yl]-1-[4-[4-[1,1,1,3,3,3-hexadeuterio-2-(trideuteriomethyl)propan-2-yl]phenyl]-2-phenylphenyl]benzimidazol-2-yl]-4-methylphenol;platinum.

Molecular Properties

• Compound Name: 2-tert-butyl-6-[4-[3-tert-butyl-5-(4-phenyl-2-pyridinyl)benzene-6-id-1-yl]-1-[4-[4-[1,1,1,3,3,3-hexadeuterio-2-(trideuteriomethyl)propan-2-yl]phenyl]-2-phenylphenyl]benzimidazol-2-yl]-4-methylphenol;platinum
• PubChem CID: 167332555
• Molecular Formula: C61H58N3OPt-
• Molecular Weight: 1053.29 g/mol
• Exact Mass: 1052.48
• IUPAC Name: 2-tert-butyl-6-[4-[3-tert-butyl-5-(4-phenyl-2-pyridinyl)benzene-6-id-1-yl]-1-[4-[4-[1,1,1,3,3,3-hexadeuterio-2-(trideuteriomethyl)propan-2-yl]phenyl]-2-phenylphenyl]benzimidazol-2-yl]-4-methylphenol;platinum
• SMILES: [2H]C([2H])([2H])C(c1ccc(-c2ccc(-n3c(-c4cc(C)cc(C(C)(C)C)c4O)nc4c(-c5[c-]c(-c6cc(-c7ccccc7)ccn6)cc(C(C)(C)C)c5)cccc43)c(-c3ccccc3)c2)cc1)(C([2H])([2H])[2H])C([2H])([2H])[2H].[Pt]
• InChI: InChI=1S/C61H58N3O.Pt/c1-39-32-51(57(65)52(33-39)61(8,9)10)58-63-56-49(45-34-46(36-48(35-45)60(5,6)7)53-38-44(30-31-62-53)40-18-13-11-14-19-40)22-17-23-55(56)64(58)54-29-26-43(37-50(54)42-20-15-12-16-21-42)41-24-27-47(28-25-41)59(2,3)4;/h11-33,35-38,65H,1-10H3;/q-1;/i2D3,3D3,4D3
• InChIKey: XLLBVGZTQXTNJV-WWMMTMLWSA-N
• XLogP: 16.13
• TPSA: 50.94 Ų
• H-Bond Donors: 1
• H-Bond Acceptors: 4
• Rotatable Bonds: 7
• Heavy Atoms: 66
• Complexity: —

Lipinski Rule of Five

2 violations

Rule	Value
MW ≤ 500	1053.29
LogP ≤ 5	16.13
H-Bond Donors ≤ 5	1
H-Bond Acceptors ≤ 10	4

Computed Properties (RDKit)

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

Frequently Asked Questions

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

The IUPAC name of 2-tert-butyl-6-[4-[3-tert-butyl-5-(4-phenyl-2-pyridinyl)benzene-6-id-1-yl]-1-[4-[4-[1,1,1,3,3,3-hexadeuterio-2-(trideuteriomethyl)propan-2-yl]phenyl]-2-phenylphenyl]benzimidazol-2-yl]-4-methylphenol;platinum (CID 167332555) is 2-tert-butyl-6-[4-[3-tert-butyl-5-(4-phenyl-2-pyridinyl)benzene-6-id-1-yl]-1-[4-[4-[1,1,1,3,3,3-hexadeuterio-2-(trideuteriomethyl)propan-2-yl]phenyl]-2-phenylphenyl]benzimidazol-2-yl]-4-methylphenol;platinum.

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

The canonical SMILES for 2-tert-butyl-6-[4-[3-tert-butyl-5-(4-phenyl-2-pyridinyl)benzene-6-id-1-yl]-1-[4-[4-[1,1,1,3,3,3-hexadeuterio-2-(trideuteriomethyl)propan-2-yl]phenyl]-2-phenylphenyl]benzimidazol-2-yl]-4-methylphenol;platinum is [2H]C([2H])([2H])C(c1ccc(-c2ccc(-n3c(-c4cc(C)cc(C(C)(C)C)c4O)nc4c(-c5[c-]c(-c6cc(-c7ccccc7)ccn6)cc(C(C)(C)C)c5)cccc43)c(-c3ccccc3)c2)cc1)(C([2H])([2H])[2H])C([2H])([2H])[2H].[Pt].

What is the InChIKey of 2-tert-butyl-6-[4-[3-tert-butyl-5-(4-phenyl-2-pyridinyl)benzene-6-id-1-yl]-1-[4-[4-[1,1,1,3,3,3-hexadeuterio-2-(trideuteriomethyl)propan-2-yl]phenyl]-2-phenylphenyl]benzimidazol-2-yl]-4-methylphenol;platinum?

The InChIKey is XLLBVGZTQXTNJV-WWMMTMLWSA-N. The full InChI is InChI=1S/C61H58N3O.Pt/c1-39-32-51(57(65)52(33-39)61(8,9)10)58-63-56-49(45-34-46(36-48(35-45)60(5,6)7)53-38-44(30-31-62-53)40-18-13-11-14-19-40)22-17-23-55(56)64(58)54-29-26-43(37-50(54)42-20-15-12-16-21-42)41-24-27-47(28-25-41)59(2,3)4;/h11-33,35-38,65H,1-10H3;/q-1;/i2D3,3D3,4D3;.

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

2-tert-butyl-6-[4-[3-tert-butyl-5-(4-phenyl-2-pyridinyl)benzene-6-id-1-yl]-1-[4-[4-[1,1,1,3,3,3-hexadeuterio-2-(trideuteriomethyl)propan-2-yl]phenyl]-2-phenylphenyl]benzimidazol-2-yl]-4-methylphenol;platinum has a molecular weight of 1053.29 g/mol, XLogP of 16.13, 7 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.

Where does this data come from?

All data for 2-tert-butyl-6-[4-[3-tert-butyl-5-(4-phenyl-2-pyridinyl)benzene-6-id-1-yl]-1-[4-[4-[1,1,1,3,3,3-hexadeuterio-2-(trideuteriomethyl)propan-2-yl]phenyl]-2-phenylphenyl]benzimidazol-2-yl]-4-methylphenol;platinum is sourced from PubChem (CID 167332555), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).