2-[4-[3-[4-[9-[3,5-bis(4-tert-butylphenyl)phenyl]carbazol-1-yl]-2-pyridinyl]-5-tert-butylbenzene-2-id-1-yl]-1-(3,5-ditert-butylphenyl)benzimidazol-2-yl]phenol;platinum

C80H79N4OPt- — CID 177093880

About 2-[4-[3-[4-[9-[3,5-bis(4-tert-butylphenyl)phenyl]carbazol-1-yl]-2-pyridinyl]-5-tert-butylbenzene-2-id-1-yl]-1-(3,5-ditert-butylphenyl)benzimidazol-2-yl]phenol;platinum

2-[4-[3-[4-[9-[3,5-bis(4-tert-butylphenyl)phenyl]carbazol-1-yl]-2-pyridinyl]-5-tert-butylbenzene-2-id-1-yl]-1-(3,5-ditert-butylphenyl)benzimidazol-2-yl]phenol;platinum (PubChem CID 177093880) has the molecular formula C80H79N4OPt- and a molecular weight of 1307.62 g/mol. Its IUPAC name is 2-[4-[3-[4-[9-[3,5-bis(4-tert-butylphenyl)phenyl]carbazol-1-yl]-2-pyridinyl]-5-tert-butylbenzene-2-id-1-yl]-1-(3,5-ditert-butylphenyl)benzimidazol-2-yl]phenol;platinum.

Molecular Properties

• Compound Name: 2-[4-[3-[4-[9-[3,5-bis(4-tert-butylphenyl)phenyl]carbazol-1-yl]-2-pyridinyl]-5-tert-butylbenzene-2-id-1-yl]-1-(3,5-ditert-butylphenyl)benzimidazol-2-yl]phenol;platinum
• PubChem CID: 177093880
• Molecular Formula: C80H79N4OPt-
• Molecular Weight: 1307.62 g/mol
• Exact Mass: 1306.59
• IUPAC Name: 2-[4-[3-[4-[9-[3,5-bis(4-tert-butylphenyl)phenyl]carbazol-1-yl]-2-pyridinyl]-5-tert-butylbenzene-2-id-1-yl]-1-(3,5-ditert-butylphenyl)benzimidazol-2-yl]phenol;platinum
• SMILES: CC(C)(C)c1ccc(-c2cc(-c3ccc(C(C)(C)C)cc3)cc(-n3c4ccccc4c4cccc(-c5ccnc(-c6[c-]c(-c7cccc8c7nc(-c7ccccc7O)n8-c7cc(C(C)(C)C)cc(C(C)(C)C)c7)cc(C(C)(C)C)c6)c5)c43)c2)cc1.[Pt]
• InChI: InChI=1S/C80H79N4O.Pt/c1-76(2,3)57-34-30-50(31-35-57)53-40-54(51-32-36-58(37-33-51)77(4,5)6)45-62(44-53)83-70-27-18-16-22-66(70)67-26-20-25-65(74(67)83)52-38-39-81-69(46-52)56-41-55(42-59(43-56)78(7,8)9)64-24-21-28-71-73(64)82-75(68-23-17-19-29-72(68)85)84(71)63-48-60(79(10,11)12)47-61(49-63)80(13,14)15;/h16-40,42-49,85H,1-15H3;/q-1
• InChIKey: YRPXAVHYNRCJDK-UHFFFAOYSA-N
• XLogP: 21.51
• TPSA: 55.87 Ų
• H-Bond Donors: 1
• H-Bond Acceptors: 5
• Rotatable Bonds: 8
• Heavy Atoms: 86
• Complexity: —

Lipinski Rule of Five

2 violations

Rule	Value
MW ≤ 500	1307.62
LogP ≤ 5	21.51
H-Bond Donors ≤ 5	1
H-Bond Acceptors ≤ 10	5

Computed Properties (RDKit)

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

Frequently Asked Questions

What is the IUPAC name of 2-[4-[3-[4-[9-[3,5-bis(4-tert-butylphenyl)phenyl]carbazol-1-yl]-2-pyridinyl]-5-tert-butylbenzene-2-id-1-yl]-1-(3,5-ditert-butylphenyl)benzimidazol-2-yl]phenol;platinum?

The IUPAC name of 2-[4-[3-[4-[9-[3,5-bis(4-tert-butylphenyl)phenyl]carbazol-1-yl]-2-pyridinyl]-5-tert-butylbenzene-2-id-1-yl]-1-(3,5-ditert-butylphenyl)benzimidazol-2-yl]phenol;platinum (CID 177093880) is 2-[4-[3-[4-[9-[3,5-bis(4-tert-butylphenyl)phenyl]carbazol-1-yl]-2-pyridinyl]-5-tert-butylbenzene-2-id-1-yl]-1-(3,5-ditert-butylphenyl)benzimidazol-2-yl]phenol;platinum.

What is the SMILES notation for 2-[4-[3-[4-[9-[3,5-bis(4-tert-butylphenyl)phenyl]carbazol-1-yl]-2-pyridinyl]-5-tert-butylbenzene-2-id-1-yl]-1-(3,5-ditert-butylphenyl)benzimidazol-2-yl]phenol;platinum?

The canonical SMILES for 2-[4-[3-[4-[9-[3,5-bis(4-tert-butylphenyl)phenyl]carbazol-1-yl]-2-pyridinyl]-5-tert-butylbenzene-2-id-1-yl]-1-(3,5-ditert-butylphenyl)benzimidazol-2-yl]phenol;platinum is CC(C)(C)c1ccc(-c2cc(-c3ccc(C(C)(C)C)cc3)cc(-n3c4ccccc4c4cccc(-c5ccnc(-c6[c-]c(-c7cccc8c7nc(-c7ccccc7O)n8-c7cc(C(C)(C)C)cc(C(C)(C)C)c7)cc(C(C)(C)C)c6)c5)c43)c2)cc1.[Pt].

What is the InChIKey of 2-[4-[3-[4-[9-[3,5-bis(4-tert-butylphenyl)phenyl]carbazol-1-yl]-2-pyridinyl]-5-tert-butylbenzene-2-id-1-yl]-1-(3,5-ditert-butylphenyl)benzimidazol-2-yl]phenol;platinum?

The InChIKey is YRPXAVHYNRCJDK-UHFFFAOYSA-N. The full InChI is InChI=1S/C80H79N4O.Pt/c1-76(2,3)57-34-30-50(31-35-57)53-40-54(51-32-36-58(37-33-51)77(4,5)6)45-62(44-53)83-70-27-18-16-22-66(70)67-26-20-25-65(74(67)83)52-38-39-81-69(46-52)56-41-55(42-59(43-56)78(7,8)9)64-24-21-28-71-73(64)82-75(68-23-17-19-29-72(68)85)84(71)63-48-60(79(10,11)12)47-61(49-63)80(13,14)15;/h16-40,42-49,85H,1-15H3;/q-1;.

What are the key properties of 2-[4-[3-[4-[9-[3,5-bis(4-tert-butylphenyl)phenyl]carbazol-1-yl]-2-pyridinyl]-5-tert-butylbenzene-2-id-1-yl]-1-(3,5-ditert-butylphenyl)benzimidazol-2-yl]phenol;platinum?

2-[4-[3-[4-[9-[3,5-bis(4-tert-butylphenyl)phenyl]carbazol-1-yl]-2-pyridinyl]-5-tert-butylbenzene-2-id-1-yl]-1-(3,5-ditert-butylphenyl)benzimidazol-2-yl]phenol;platinum has a molecular weight of 1307.62 g/mol, XLogP of 21.51, 8 rotatable bonds, 1 hydrogen bond donors, and 5 hydrogen bond acceptors.

Where does this data come from?

All data for 2-[4-[3-[4-[9-[3,5-bis(4-tert-butylphenyl)phenyl]carbazol-1-yl]-2-pyridinyl]-5-tert-butylbenzene-2-id-1-yl]-1-(3,5-ditert-butylphenyl)benzimidazol-2-yl]phenol;platinum is sourced from PubChem (CID 177093880), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).