2,4-ditert-butyl-6-[4-[3-tert-butyl-5-(1-phenyl-[1]benzofuro[3,2-e]benzimidazol-2-yl)benzene-6-id-1-yl]-1-(2-phenylphenyl)benzimidazol-2-yl]phenol;platinum

C62H55N4O2Pt- — CID 169309293

About 2,4-ditert-butyl-6-[4-[3-tert-butyl-5-(1-phenyl-[1]benzofuro[3,2-e]benzimidazol-2-yl)benzene-6-id-1-yl]-1-(2-phenylphenyl)benzimidazol-2-yl]phenol;platinum

2,4-ditert-butyl-6-[4-[3-tert-butyl-5-(1-phenyl-[1]benzofuro[3,2-e]benzimidazol-2-yl)benzene-6-id-1-yl]-1-(2-phenylphenyl)benzimidazol-2-yl]phenol;platinum (PubChem CID 169309293) has the molecular formula C62H55N4O2Pt- and a molecular weight of 1083.23 g/mol. Its IUPAC name is 2,4-ditert-butyl-6-[4-[3-tert-butyl-5-(1-phenyl-[1]benzofuro[3,2-e]benzimidazol-2-yl)benzene-6-id-1-yl]-1-(2-phenylphenyl)benzimidazol-2-yl]phenol;platinum.

Molecular Properties

• Compound Name: 2,4-ditert-butyl-6-[4-[3-tert-butyl-5-(1-phenyl-[1]benzofuro[3,2-e]benzimidazol-2-yl)benzene-6-id-1-yl]-1-(2-phenylphenyl)benzimidazol-2-yl]phenol;platinum
• PubChem CID: 169309293
• Molecular Formula: C62H55N4O2Pt-
• Molecular Weight: 1083.23 g/mol
• Exact Mass: 1082.40
• IUPAC Name: 2,4-ditert-butyl-6-[4-[3-tert-butyl-5-(1-phenyl-[1]benzofuro[3,2-e]benzimidazol-2-yl)benzene-6-id-1-yl]-1-(2-phenylphenyl)benzimidazol-2-yl]phenol;platinum
• SMILES: CC(C)(C)c1cc(-c2cccc3c2nc(-c2cc(C(C)(C)C)cc(C(C)(C)C)c2O)n3-c2ccccc2-c2ccccc2)[c-]c(-c2nc3ccc4oc5ccccc5c4c3n2-c2ccccc2)c1.[Pt]
• InChI: InChI=1S/C62H55N4O2.Pt/c1-60(2,3)41-34-39(33-40(35-41)58-63-49-31-32-53-54(46-26-17-19-30-52(46)68-53)56(49)65(58)43-23-14-11-15-24-43)45-27-20-29-51-55(45)64-59(47-36-42(61(4,5)6)37-48(57(47)67)62(7,8)9)66(51)50-28-18-16-25-44(50)38-21-12-10-13-22-38;/h10-32,34-37,67H,1-9H3;/q-1
• InChIKey: KOTWUONUNFFEQE-UHFFFAOYSA-N
• XLogP: 16.33
• TPSA: 69.01 Ų
• H-Bond Donors: 1
• H-Bond Acceptors: 6
• Rotatable Bonds: 6
• Heavy Atoms: 69
• Complexity: —

Lipinski Rule of Five

2 violations

Rule	Value
MW ≤ 500	1083.23
LogP ≤ 5	16.33
H-Bond Donors ≤ 5	1
H-Bond Acceptors ≤ 10	6

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-tert-butyl-5-(1-phenyl-[1]benzofuro[3,2-e]benzimidazol-2-yl)benzene-6-id-1-yl]-1-(2-phenylphenyl)benzimidazol-2-yl]phenol;platinum?

The IUPAC name of 2,4-ditert-butyl-6-[4-[3-tert-butyl-5-(1-phenyl-[1]benzofuro[3,2-e]benzimidazol-2-yl)benzene-6-id-1-yl]-1-(2-phenylphenyl)benzimidazol-2-yl]phenol;platinum (CID 169309293) is 2,4-ditert-butyl-6-[4-[3-tert-butyl-5-(1-phenyl-[1]benzofuro[3,2-e]benzimidazol-2-yl)benzene-6-id-1-yl]-1-(2-phenylphenyl)benzimidazol-2-yl]phenol;platinum.

What is the SMILES notation for 2,4-ditert-butyl-6-[4-[3-tert-butyl-5-(1-phenyl-[1]benzofuro[3,2-e]benzimidazol-2-yl)benzene-6-id-1-yl]-1-(2-phenylphenyl)benzimidazol-2-yl]phenol;platinum?

The canonical SMILES for 2,4-ditert-butyl-6-[4-[3-tert-butyl-5-(1-phenyl-[1]benzofuro[3,2-e]benzimidazol-2-yl)benzene-6-id-1-yl]-1-(2-phenylphenyl)benzimidazol-2-yl]phenol;platinum is CC(C)(C)c1cc(-c2cccc3c2nc(-c2cc(C(C)(C)C)cc(C(C)(C)C)c2O)n3-c2ccccc2-c2ccccc2)[c-]c(-c2nc3ccc4oc5ccccc5c4c3n2-c2ccccc2)c1.[Pt].

What is the InChIKey of 2,4-ditert-butyl-6-[4-[3-tert-butyl-5-(1-phenyl-[1]benzofuro[3,2-e]benzimidazol-2-yl)benzene-6-id-1-yl]-1-(2-phenylphenyl)benzimidazol-2-yl]phenol;platinum?

The InChIKey is KOTWUONUNFFEQE-UHFFFAOYSA-N. The full InChI is InChI=1S/C62H55N4O2.Pt/c1-60(2,3)41-34-39(33-40(35-41)58-63-49-31-32-53-54(46-26-17-19-30-52(46)68-53)56(49)65(58)43-23-14-11-15-24-43)45-27-20-29-51-55(45)64-59(47-36-42(61(4,5)6)37-48(57(47)67)62(7,8)9)66(51)50-28-18-16-25-44(50)38-21-12-10-13-22-38;/h10-32,34-37,67H,1-9H3;/q-1;.

What are the key properties of 2,4-ditert-butyl-6-[4-[3-tert-butyl-5-(1-phenyl-[1]benzofuro[3,2-e]benzimidazol-2-yl)benzene-6-id-1-yl]-1-(2-phenylphenyl)benzimidazol-2-yl]phenol;platinum?

2,4-ditert-butyl-6-[4-[3-tert-butyl-5-(1-phenyl-[1]benzofuro[3,2-e]benzimidazol-2-yl)benzene-6-id-1-yl]-1-(2-phenylphenyl)benzimidazol-2-yl]phenol;platinum has a molecular weight of 1083.23 g/mol, XLogP of 16.33, 6 rotatable bonds, 1 hydrogen bond donors, and 6 hydrogen bond acceptors.

Where does this data come from?

All data for 2,4-ditert-butyl-6-[4-[3-tert-butyl-5-(1-phenyl-[1]benzofuro[3,2-e]benzimidazol-2-yl)benzene-6-id-1-yl]-1-(2-phenylphenyl)benzimidazol-2-yl]phenol;platinum is sourced from PubChem (CID 169309293), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).