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

C67H70N3OPt- — CID 153477627

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

2,4-ditert-butyl-6-[1-[5-tert-butyl-2-(4-tert-butylphenyl)phenyl]-4-[3-[4-[4-(2-deuteriopropan-2-yl)phenyl]-2-pyridinyl]-5-phenylbenzene-2-id-1-yl]benzimidazol-2-yl]phenol;platinum (PubChem CID 153477627) has the molecular formula C67H70N3OPt- and a molecular weight of 1129.40 g/mol. Its IUPAC name is 2,4-ditert-butyl-6-[1-[5-tert-butyl-2-(4-tert-butylphenyl)phenyl]-4-[3-[4-[4-(2-deuteriopropan-2-yl)phenyl]-2-pyridinyl]-5-phenylbenzene-2-id-1-yl]benzimidazol-2-yl]phenol;platinum.

Molecular Properties

• Compound Name: 2,4-ditert-butyl-6-[1-[5-tert-butyl-2-(4-tert-butylphenyl)phenyl]-4-[3-[4-[4-(2-deuteriopropan-2-yl)phenyl]-2-pyridinyl]-5-phenylbenzene-2-id-1-yl]benzimidazol-2-yl]phenol;platinum
• PubChem CID: 153477627
• Molecular Formula: C67H70N3OPt-
• Molecular Weight: 1129.40 g/mol
• Exact Mass: 1128.52
• IUPAC Name: 2,4-ditert-butyl-6-[1-[5-tert-butyl-2-(4-tert-butylphenyl)phenyl]-4-[3-[4-[4-(2-deuteriopropan-2-yl)phenyl]-2-pyridinyl]-5-phenylbenzene-2-id-1-yl]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-c4cc(C(C)(C)C)ccc4-c4ccc(C(C)(C)C)cc4)cc(-c4ccccc4)c3)c2)cc1.[Pt]
• InChI: InChI=1S/C67H70N3O.Pt/c1-42(2)43-23-25-45(26-24-43)47-33-34-68-58(38-47)50-36-48(44-19-16-15-17-20-44)35-49(37-50)55-21-18-22-59-61(55)69-63(56-39-53(66(9,10)11)40-57(62(56)71)67(12,13)14)70(59)60-41-52(65(6,7)8)31-32-54(60)46-27-29-51(30-28-46)64(3,4)5;/h15-36,38-42,71H,1-14H3;/q-1;/i42D
• InChIKey: VZJJBJCMMMASAH-AJYJKQKESA-N
• XLogP: 18.24
• TPSA: 50.94 Ų
• H-Bond Donors: 1
• H-Bond Acceptors: 4
• Rotatable Bonds: 8
• Heavy Atoms: 72
• Complexity: —

Lipinski Rule of Five

2 violations

Rule	Value
MW ≤ 500	1129.40
LogP ≤ 5	18.24
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-[1-[5-tert-butyl-2-(4-tert-butylphenyl)phenyl]-4-[3-[4-[4-(2-deuteriopropan-2-yl)phenyl]-2-pyridinyl]-5-phenylbenzene-2-id-1-yl]benzimidazol-2-yl]phenol;platinum?

The IUPAC name of 2,4-ditert-butyl-6-[1-[5-tert-butyl-2-(4-tert-butylphenyl)phenyl]-4-[3-[4-[4-(2-deuteriopropan-2-yl)phenyl]-2-pyridinyl]-5-phenylbenzene-2-id-1-yl]benzimidazol-2-yl]phenol;platinum (CID 153477627) is 2,4-ditert-butyl-6-[1-[5-tert-butyl-2-(4-tert-butylphenyl)phenyl]-4-[3-[4-[4-(2-deuteriopropan-2-yl)phenyl]-2-pyridinyl]-5-phenylbenzene-2-id-1-yl]benzimidazol-2-yl]phenol;platinum.

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

The canonical SMILES for 2,4-ditert-butyl-6-[1-[5-tert-butyl-2-(4-tert-butylphenyl)phenyl]-4-[3-[4-[4-(2-deuteriopropan-2-yl)phenyl]-2-pyridinyl]-5-phenylbenzene-2-id-1-yl]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-c4cc(C(C)(C)C)ccc4-c4ccc(C(C)(C)C)cc4)cc(-c4ccccc4)c3)c2)cc1.[Pt].

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

The InChIKey is VZJJBJCMMMASAH-AJYJKQKESA-N. The full InChI is InChI=1S/C67H70N3O.Pt/c1-42(2)43-23-25-45(26-24-43)47-33-34-68-58(38-47)50-36-48(44-19-16-15-17-20-44)35-49(37-50)55-21-18-22-59-61(55)69-63(56-39-53(66(9,10)11)40-57(62(56)71)67(12,13)14)70(59)60-41-52(65(6,7)8)31-32-54(60)46-27-29-51(30-28-46)64(3,4)5;/h15-36,38-42,71H,1-14H3;/q-1;/i42D;.

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

2,4-ditert-butyl-6-[1-[5-tert-butyl-2-(4-tert-butylphenyl)phenyl]-4-[3-[4-[4-(2-deuteriopropan-2-yl)phenyl]-2-pyridinyl]-5-phenylbenzene-2-id-1-yl]benzimidazol-2-yl]phenol;platinum has a molecular weight of 1129.40 g/mol, XLogP of 18.24, 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-[1-[5-tert-butyl-2-(4-tert-butylphenyl)phenyl]-4-[3-[4-[4-(2-deuteriopropan-2-yl)phenyl]-2-pyridinyl]-5-phenylbenzene-2-id-1-yl]benzimidazol-2-yl]phenol;platinum is sourced from PubChem (CID 153477627), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).