2,4-ditert-butyl-6-[4-[3-[4-[4-(2-deuteriopropan-2-yl)phenyl]-2-pyridinyl]-5-phenylbenzene-2-id-1-yl]-1-[4-(3,5-ditert-butylphenyl)-2-methylphenyl]benzimidazol-2-yl]phenol;platinum

C68H72N3OPt- — CID 164701361

About 2,4-ditert-butyl-6-[4-[3-[4-[4-(2-deuteriopropan-2-yl)phenyl]-2-pyridinyl]-5-phenylbenzene-2-id-1-yl]-1-[4-(3,5-ditert-butylphenyl)-2-methylphenyl]benzimidazol-2-yl]phenol;platinum

2,4-ditert-butyl-6-[4-[3-[4-[4-(2-deuteriopropan-2-yl)phenyl]-2-pyridinyl]-5-phenylbenzene-2-id-1-yl]-1-[4-(3,5-ditert-butylphenyl)-2-methylphenyl]benzimidazol-2-yl]phenol;platinum (PubChem CID 164701361) has the molecular formula C68H72N3OPt- and a molecular weight of 1143.43 g/mol. Its IUPAC name is 2,4-ditert-butyl-6-[4-[3-[4-[4-(2-deuteriopropan-2-yl)phenyl]-2-pyridinyl]-5-phenylbenzene-2-id-1-yl]-1-[4-(3,5-ditert-butylphenyl)-2-methylphenyl]benzimidazol-2-yl]phenol;platinum.

Molecular Properties

• Compound Name: 2,4-ditert-butyl-6-[4-[3-[4-[4-(2-deuteriopropan-2-yl)phenyl]-2-pyridinyl]-5-phenylbenzene-2-id-1-yl]-1-[4-(3,5-ditert-butylphenyl)-2-methylphenyl]benzimidazol-2-yl]phenol;platinum
• PubChem CID: 164701361
• Molecular Formula: C68H72N3OPt-
• Molecular Weight: 1143.43 g/mol
• Exact Mass: 1142.54
• IUPAC Name: 2,4-ditert-butyl-6-[4-[3-[4-[4-(2-deuteriopropan-2-yl)phenyl]-2-pyridinyl]-5-phenylbenzene-2-id-1-yl]-1-[4-(3,5-ditert-butylphenyl)-2-methylphenyl]benzimidazol-2-yl]phenol;platinum
• SMILES: [2H]C(C)(C)c1ccc(-c2ccnc(-c3[c-]c(-c4cccc5c4nc(-c4cc(C(C)(C)C)cc(C(C)(C)C)c4O)n5-c4ccc(-c5cc(C(C)(C)C)cc(C(C)(C)C)c5)cc4C)cc(-c4ccccc4)c3)c2)cc1.[Pt]
• InChI: InChI=1S/C68H72N3O.Pt/c1-42(2)44-24-26-46(27-25-44)48-30-31-69-59(38-48)52-34-49(45-20-17-16-18-21-45)33-51(35-52)56-22-19-23-61-62(56)70-64(57-40-55(67(10,11)12)41-58(63(57)72)68(13,14)15)71(61)60-29-28-47(32-43(60)3)50-36-53(65(4,5)6)39-54(37-50)66(7,8)9;/h16-34,36-42,72H,1-15H3;/q-1;/i42D
• InChIKey: JIQCQEFVNWMQCF-AJYJKQKESA-N
• XLogP: 18.55
• TPSA: 50.94 Ų
• H-Bond Donors: 1
• H-Bond Acceptors: 4
• Rotatable Bonds: 8
• Heavy Atoms: 73
• Complexity: —

Lipinski Rule of Five

2 violations

Rule	Value
MW ≤ 500	1143.43
LogP ≤ 5	18.55
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 2,4-ditert-butyl-6-[4-[3-[4-[4-(2-deuteriopropan-2-yl)phenyl]-2-pyridinyl]-5-phenylbenzene-2-id-1-yl]-1-[4-(3,5-ditert-butylphenyl)-2-methylphenyl]benzimidazol-2-yl]phenol;platinum?

The IUPAC name of 2,4-ditert-butyl-6-[4-[3-[4-[4-(2-deuteriopropan-2-yl)phenyl]-2-pyridinyl]-5-phenylbenzene-2-id-1-yl]-1-[4-(3,5-ditert-butylphenyl)-2-methylphenyl]benzimidazol-2-yl]phenol;platinum (CID 164701361) is 2,4-ditert-butyl-6-[4-[3-[4-[4-(2-deuteriopropan-2-yl)phenyl]-2-pyridinyl]-5-phenylbenzene-2-id-1-yl]-1-[4-(3,5-ditert-butylphenyl)-2-methylphenyl]benzimidazol-2-yl]phenol;platinum.

What is the SMILES notation for 2,4-ditert-butyl-6-[4-[3-[4-[4-(2-deuteriopropan-2-yl)phenyl]-2-pyridinyl]-5-phenylbenzene-2-id-1-yl]-1-[4-(3,5-ditert-butylphenyl)-2-methylphenyl]benzimidazol-2-yl]phenol;platinum?

The canonical SMILES for 2,4-ditert-butyl-6-[4-[3-[4-[4-(2-deuteriopropan-2-yl)phenyl]-2-pyridinyl]-5-phenylbenzene-2-id-1-yl]-1-[4-(3,5-ditert-butylphenyl)-2-methylphenyl]benzimidazol-2-yl]phenol;platinum is [2H]C(C)(C)c1ccc(-c2ccnc(-c3[c-]c(-c4cccc5c4nc(-c4cc(C(C)(C)C)cc(C(C)(C)C)c4O)n5-c4ccc(-c5cc(C(C)(C)C)cc(C(C)(C)C)c5)cc4C)cc(-c4ccccc4)c3)c2)cc1.[Pt].

What is the InChIKey of 2,4-ditert-butyl-6-[4-[3-[4-[4-(2-deuteriopropan-2-yl)phenyl]-2-pyridinyl]-5-phenylbenzene-2-id-1-yl]-1-[4-(3,5-ditert-butylphenyl)-2-methylphenyl]benzimidazol-2-yl]phenol;platinum?

The InChIKey is JIQCQEFVNWMQCF-AJYJKQKESA-N. The full InChI is InChI=1S/C68H72N3O.Pt/c1-42(2)44-24-26-46(27-25-44)48-30-31-69-59(38-48)52-34-49(45-20-17-16-18-21-45)33-51(35-52)56-22-19-23-61-62(56)70-64(57-40-55(67(10,11)12)41-58(63(57)72)68(13,14)15)71(61)60-29-28-47(32-43(60)3)50-36-53(65(4,5)6)39-54(37-50)66(7,8)9;/h16-34,36-42,72H,1-15H3;/q-1;/i42D;.

What are the key properties of 2,4-ditert-butyl-6-[4-[3-[4-[4-(2-deuteriopropan-2-yl)phenyl]-2-pyridinyl]-5-phenylbenzene-2-id-1-yl]-1-[4-(3,5-ditert-butylphenyl)-2-methylphenyl]benzimidazol-2-yl]phenol;platinum?

2,4-ditert-butyl-6-[4-[3-[4-[4-(2-deuteriopropan-2-yl)phenyl]-2-pyridinyl]-5-phenylbenzene-2-id-1-yl]-1-[4-(3,5-ditert-butylphenyl)-2-methylphenyl]benzimidazol-2-yl]phenol;platinum has a molecular weight of 1143.43 g/mol, XLogP of 18.55, 8 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.

Where does this data come from?

All data for 2,4-ditert-butyl-6-[4-[3-[4-[4-(2-deuteriopropan-2-yl)phenyl]-2-pyridinyl]-5-phenylbenzene-2-id-1-yl]-1-[4-(3,5-ditert-butylphenyl)-2-methylphenyl]benzimidazol-2-yl]phenol;platinum is sourced from PubChem (CID 164701361), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).