2-[1-[4-phenyl-2,6-di(propan-2-yl)phenyl]-4-[3-[3-[2,4,6-tri(propan-2-yl)phenyl]-2H-benzimidazol-2-id-1-yl]benzene-2-id-1-yl]imidazol-2-yl]phenol;platinum(2+)

C55H58N4OPt — CID 162491810

About 2-[1-[4-phenyl-2,6-di(propan-2-yl)phenyl]-4-[3-[3-[2,4,6-tri(propan-2-yl)phenyl]-2H-benzimidazol-2-id-1-yl]benzene-2-id-1-yl]imidazol-2-yl]phenol;platinum(2+)

2-[1-[4-phenyl-2,6-di(propan-2-yl)phenyl]-4-[3-[3-[2,4,6-tri(propan-2-yl)phenyl]-2H-benzimidazol-2-id-1-yl]benzene-2-id-1-yl]imidazol-2-yl]phenol;platinum(2+) (PubChem CID 162491810) has the molecular formula C55H58N4OPt and a molecular weight of 986.17 g/mol. Its IUPAC name is 2-[1-[4-phenyl-2,6-di(propan-2-yl)phenyl]-4-[3-[3-[2,4,6-tri(propan-2-yl)phenyl]-2H-benzimidazol-2-id-1-yl]benzene-2-id-1-yl]imidazol-2-yl]phenol;platinum(2+).

Molecular Properties

• Compound Name: 2-[1-[4-phenyl-2,6-di(propan-2-yl)phenyl]-4-[3-[3-[2,4,6-tri(propan-2-yl)phenyl]-2H-benzimidazol-2-id-1-yl]benzene-2-id-1-yl]imidazol-2-yl]phenol;platinum(2+)
• PubChem CID: 162491810
• Molecular Formula: C55H58N4OPt
• Molecular Weight: 986.17 g/mol
• Exact Mass: 985.43
• IUPAC Name: 2-[1-[4-phenyl-2,6-di(propan-2-yl)phenyl]-4-[3-[3-[2,4,6-tri(propan-2-yl)phenyl]-2H-benzimidazol-2-id-1-yl]benzene-2-id-1-yl]imidazol-2-yl]phenol;platinum(2+)
• SMILES: CC(C)c1cc(C(C)C)c(N2[CH-]N(c3[c-]c(-c4cn(-c5c(C(C)C)cc(-c6ccccc6)cc5C(C)C)c(-c5ccccc5O)n4)ccc3)c3ccccc32)c(C(C)C)c1.[Pt+2]
• InChI: InChI=1S/C55H58N4O.Pt/c1-34(2)41-28-45(35(3)4)54(46(29-41)36(5)6)59-33-58(50-24-15-16-25-51(50)59)43-22-18-21-40(27-43)49-32-57(55(56-49)44-23-14-17-26-52(44)60)53-47(37(7)8)30-42(31-48(53)38(9)10)39-19-12-11-13-20-39;/h11-26,28-38,60H,1-10H3;/q-2;+2
• InChIKey: VEZJEXFULWXEDO-UHFFFAOYSA-N
• XLogP: 15.40
• TPSA: 44.53 Ų
• H-Bond Donors: 1
• H-Bond Acceptors: 5
• Rotatable Bonds: 11
• Heavy Atoms: 61
• Complexity: —

Lipinski Rule of Five

2 violations

Rule	Value
MW ≤ 500	986.17
LogP ≤ 5	15.40
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-[1-[4-phenyl-2,6-di(propan-2-yl)phenyl]-4-[3-[3-[2,4,6-tri(propan-2-yl)phenyl]-2H-benzimidazol-2-id-1-yl]benzene-2-id-1-yl]imidazol-2-yl]phenol;platinum(2+)?

The IUPAC name of 2-[1-[4-phenyl-2,6-di(propan-2-yl)phenyl]-4-[3-[3-[2,4,6-tri(propan-2-yl)phenyl]-2H-benzimidazol-2-id-1-yl]benzene-2-id-1-yl]imidazol-2-yl]phenol;platinum(2+) (CID 162491810) is 2-[1-[4-phenyl-2,6-di(propan-2-yl)phenyl]-4-[3-[3-[2,4,6-tri(propan-2-yl)phenyl]-2H-benzimidazol-2-id-1-yl]benzene-2-id-1-yl]imidazol-2-yl]phenol;platinum(2+).

What is the SMILES notation for 2-[1-[4-phenyl-2,6-di(propan-2-yl)phenyl]-4-[3-[3-[2,4,6-tri(propan-2-yl)phenyl]-2H-benzimidazol-2-id-1-yl]benzene-2-id-1-yl]imidazol-2-yl]phenol;platinum(2+)?

The canonical SMILES for 2-[1-[4-phenyl-2,6-di(propan-2-yl)phenyl]-4-[3-[3-[2,4,6-tri(propan-2-yl)phenyl]-2H-benzimidazol-2-id-1-yl]benzene-2-id-1-yl]imidazol-2-yl]phenol;platinum(2+) is CC(C)c1cc(C(C)C)c(N2[CH-]N(c3[c-]c(-c4cn(-c5c(C(C)C)cc(-c6ccccc6)cc5C(C)C)c(-c5ccccc5O)n4)ccc3)c3ccccc32)c(C(C)C)c1.[Pt+2].

What is the InChIKey of 2-[1-[4-phenyl-2,6-di(propan-2-yl)phenyl]-4-[3-[3-[2,4,6-tri(propan-2-yl)phenyl]-2H-benzimidazol-2-id-1-yl]benzene-2-id-1-yl]imidazol-2-yl]phenol;platinum(2+)?

The InChIKey is VEZJEXFULWXEDO-UHFFFAOYSA-N. The full InChI is InChI=1S/C55H58N4O.Pt/c1-34(2)41-28-45(35(3)4)54(46(29-41)36(5)6)59-33-58(50-24-15-16-25-51(50)59)43-22-18-21-40(27-43)49-32-57(55(56-49)44-23-14-17-26-52(44)60)53-47(37(7)8)30-42(31-48(53)38(9)10)39-19-12-11-13-20-39;/h11-26,28-38,60H,1-10H3;/q-2;+2.

What are the key properties of 2-[1-[4-phenyl-2,6-di(propan-2-yl)phenyl]-4-[3-[3-[2,4,6-tri(propan-2-yl)phenyl]-2H-benzimidazol-2-id-1-yl]benzene-2-id-1-yl]imidazol-2-yl]phenol;platinum(2+)?

2-[1-[4-phenyl-2,6-di(propan-2-yl)phenyl]-4-[3-[3-[2,4,6-tri(propan-2-yl)phenyl]-2H-benzimidazol-2-id-1-yl]benzene-2-id-1-yl]imidazol-2-yl]phenol;platinum(2+) has a molecular weight of 986.17 g/mol, XLogP of 15.40, 11 rotatable bonds, 1 hydrogen bond donors, and 5 hydrogen bond acceptors.

Where does this data come from?

All data for 2-[1-[4-phenyl-2,6-di(propan-2-yl)phenyl]-4-[3-[3-[2,4,6-tri(propan-2-yl)phenyl]-2H-benzimidazol-2-id-1-yl]benzene-2-id-1-yl]imidazol-2-yl]phenol;platinum(2+) is sourced from PubChem (CID 162491810), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).