1-(2-phenylphenyl)-2-[7-phenyl-2-[3-[3-phenyl-4-(trideuteriomethyl)benzene-6-id-1-yl]benzene-2-id-1-yl]oxy-3H-dibenzofuran-3-id-4-yl]benzimidazole;platinum

C56H35N2O2Pt-3 — CID 170543494

About 1-(2-phenylphenyl)-2-[7-phenyl-2-[3-[3-phenyl-4-(trideuteriomethyl)benzene-6-id-1-yl]benzene-2-id-1-yl]oxy-3H-dibenzofuran-3-id-4-yl]benzimidazole;platinum

1-(2-phenylphenyl)-2-[7-phenyl-2-[3-[3-phenyl-4-(trideuteriomethyl)benzene-6-id-1-yl]benzene-2-id-1-yl]oxy-3H-dibenzofuran-3-id-4-yl]benzimidazole;platinum (PubChem CID 170543494) has the molecular formula C56H35N2O2Pt-3 and a molecular weight of 966.00 g/mol. Its IUPAC name is 1-(2-phenylphenyl)-2-[7-phenyl-2-[3-[3-phenyl-4-(trideuteriomethyl)benzene-6-id-1-yl]benzene-2-id-1-yl]oxy-3H-dibenzofuran-3-id-4-yl]benzimidazole;platinum.

Molecular Properties

• Compound Name: 1-(2-phenylphenyl)-2-[7-phenyl-2-[3-[3-phenyl-4-(trideuteriomethyl)benzene-6-id-1-yl]benzene-2-id-1-yl]oxy-3H-dibenzofuran-3-id-4-yl]benzimidazole;platinum
• PubChem CID: 170543494
• Molecular Formula: C56H35N2O2Pt-3
• Molecular Weight: 966.00 g/mol
• Exact Mass: 965.26
• IUPAC Name: 1-(2-phenylphenyl)-2-[7-phenyl-2-[3-[3-phenyl-4-(trideuteriomethyl)benzene-6-id-1-yl]benzene-2-id-1-yl]oxy-3H-dibenzofuran-3-id-4-yl]benzimidazole;platinum
• SMILES: [2H]C([2H])([2H])c1c[c-]c(-c2[c-]c(Oc3[c-]c(-c4nc5ccccc5n4-c4ccccc4-c4ccccc4)c4oc5cc(-c6ccccc6)ccc5c4c3)ccc2)cc1-c1ccccc1.[Pt]
• InChI: InChI=1S/C56H35N2O2.Pt/c1-37-28-29-42(33-48(37)40-20-9-4-10-21-40)41-22-15-23-44(32-41)59-45-35-49-47-31-30-43(38-16-5-2-6-17-38)34-54(47)60-55(49)50(36-45)56-57-51-25-12-14-27-53(51)58(56)52-26-13-11-24-46(52)39-18-7-3-8-19-39;/h2-28,30-31,33-35H,1H3;/q-3;/i1D3
• InChIKey: QHGAGVRICCHEKW-NIIDSAIPSA-N
• XLogP: 14.76
• TPSA: 40.19 Ų
• H-Bond Acceptors: 4
• Rotatable Bonds: 9
• Heavy Atoms: 61
• Complexity: —

Lipinski Rule of Five

2 violations

Rule	Value
MW ≤ 500	966.00
LogP ≤ 5	14.76
H-Bond Donors ≤ 5	0
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 1-(2-phenylphenyl)-2-[7-phenyl-2-[3-[3-phenyl-4-(trideuteriomethyl)benzene-6-id-1-yl]benzene-2-id-1-yl]oxy-3H-dibenzofuran-3-id-4-yl]benzimidazole;platinum?

The IUPAC name of 1-(2-phenylphenyl)-2-[7-phenyl-2-[3-[3-phenyl-4-(trideuteriomethyl)benzene-6-id-1-yl]benzene-2-id-1-yl]oxy-3H-dibenzofuran-3-id-4-yl]benzimidazole;platinum (CID 170543494) is 1-(2-phenylphenyl)-2-[7-phenyl-2-[3-[3-phenyl-4-(trideuteriomethyl)benzene-6-id-1-yl]benzene-2-id-1-yl]oxy-3H-dibenzofuran-3-id-4-yl]benzimidazole;platinum.

What is the SMILES notation for 1-(2-phenylphenyl)-2-[7-phenyl-2-[3-[3-phenyl-4-(trideuteriomethyl)benzene-6-id-1-yl]benzene-2-id-1-yl]oxy-3H-dibenzofuran-3-id-4-yl]benzimidazole;platinum?

The canonical SMILES for 1-(2-phenylphenyl)-2-[7-phenyl-2-[3-[3-phenyl-4-(trideuteriomethyl)benzene-6-id-1-yl]benzene-2-id-1-yl]oxy-3H-dibenzofuran-3-id-4-yl]benzimidazole;platinum is [2H]C([2H])([2H])c1c[c-]c(-c2[c-]c(Oc3[c-]c(-c4nc5ccccc5n4-c4ccccc4-c4ccccc4)c4oc5cc(-c6ccccc6)ccc5c4c3)ccc2)cc1-c1ccccc1.[Pt].

What is the InChIKey of 1-(2-phenylphenyl)-2-[7-phenyl-2-[3-[3-phenyl-4-(trideuteriomethyl)benzene-6-id-1-yl]benzene-2-id-1-yl]oxy-3H-dibenzofuran-3-id-4-yl]benzimidazole;platinum?

The InChIKey is QHGAGVRICCHEKW-NIIDSAIPSA-N. The full InChI is InChI=1S/C56H35N2O2.Pt/c1-37-28-29-42(33-48(37)40-20-9-4-10-21-40)41-22-15-23-44(32-41)59-45-35-49-47-31-30-43(38-16-5-2-6-17-38)34-54(47)60-55(49)50(36-45)56-57-51-25-12-14-27-53(51)58(56)52-26-13-11-24-46(52)39-18-7-3-8-19-39;/h2-28,30-31,33-35H,1H3;/q-3;/i1D3;.

What are the key properties of 1-(2-phenylphenyl)-2-[7-phenyl-2-[3-[3-phenyl-4-(trideuteriomethyl)benzene-6-id-1-yl]benzene-2-id-1-yl]oxy-3H-dibenzofuran-3-id-4-yl]benzimidazole;platinum?

1-(2-phenylphenyl)-2-[7-phenyl-2-[3-[3-phenyl-4-(trideuteriomethyl)benzene-6-id-1-yl]benzene-2-id-1-yl]oxy-3H-dibenzofuran-3-id-4-yl]benzimidazole;platinum has a molecular weight of 966.00 g/mol, XLogP of 14.76, 9 rotatable bonds, 0 hydrogen bond donors, and 4 hydrogen bond acceptors.

Where does this data come from?

All data for 1-(2-phenylphenyl)-2-[7-phenyl-2-[3-[3-phenyl-4-(trideuteriomethyl)benzene-6-id-1-yl]benzene-2-id-1-yl]oxy-3H-dibenzofuran-3-id-4-yl]benzimidazole;platinum is sourced from PubChem (CID 170543494), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).