2-[3-[5-tert-butyl-3-[3-tert-butyl-5-(2-phenylpropan-2-yl)phenyl]-2H-benzimidazol-2-id-1-yl]-5-phenylbenzene-2-id-1-yl]oxy-9-(4-tert-butyl-2-pyridinyl)-1H-carbazol-1-ide;carbanide;platinum(4+)

C64H64N4OPt — CID 162448067

About 2-[3-[5-tert-butyl-3-[3-tert-butyl-5-(2-phenylpropan-2-yl)phenyl]-2H-benzimidazol-2-id-1-yl]-5-phenylbenzene-2-id-1-yl]oxy-9-(4-tert-butyl-2-pyridinyl)-1H-carbazol-1-ide;carbanide;platinum(4+)

2-[3-[5-tert-butyl-3-[3-tert-butyl-5-(2-phenylpropan-2-yl)phenyl]-2H-benzimidazol-2-id-1-yl]-5-phenylbenzene-2-id-1-yl]oxy-9-(4-tert-butyl-2-pyridinyl)-1H-carbazol-1-ide;carbanide;platinum(4+) (PubChem CID 162448067) has the molecular formula C64H64N4OPt and a molecular weight of 1100.32 g/mol. Its IUPAC name is 2-[3-[5-tert-butyl-3-[3-tert-butyl-5-(2-phenylpropan-2-yl)phenyl]-2H-benzimidazol-2-id-1-yl]-5-phenylbenzene-2-id-1-yl]oxy-9-(4-tert-butyl-2-pyridinyl)-1H-carbazol-1-ide;carbanide;platinum(4+).

Molecular Properties

• Compound Name: 2-[3-[5-tert-butyl-3-[3-tert-butyl-5-(2-phenylpropan-2-yl)phenyl]-2H-benzimidazol-2-id-1-yl]-5-phenylbenzene-2-id-1-yl]oxy-9-(4-tert-butyl-2-pyridinyl)-1H-carbazol-1-ide;carbanide;platinum(4+)
• PubChem CID: 162448067
• Molecular Formula: C64H64N4OPt
• Molecular Weight: 1100.32 g/mol
• Exact Mass: 1099.47
• IUPAC Name: 2-[3-[5-tert-butyl-3-[3-tert-butyl-5-(2-phenylpropan-2-yl)phenyl]-2H-benzimidazol-2-id-1-yl]-5-phenylbenzene-2-id-1-yl]oxy-9-(4-tert-butyl-2-pyridinyl)-1H-carbazol-1-ide;carbanide;platinum(4+)
• SMILES: CC(C)(C)c1cc(N2[CH-]N(c3[c-]c(Oc4[c-]c5c(cc4)c4ccccc4n5-c4cc(C(C)(C)C)ccn4)cc(-c4ccccc4)c3)c3ccc(C(C)(C)C)cc32)cc(C(C)(C)c2ccccc2)c1.[CH3-].[Pt+4]
• InChI: InChI=1S/C63H61N4O.CH3.Pt/c1-60(2,3)45-26-29-56-58(37-45)66(50-35-47(62(7,8)9)34-48(36-50)63(10,11)44-22-16-13-17-23-44)41-65(56)49-32-43(42-20-14-12-15-21-42)33-52(39-49)68-51-27-28-54-53-24-18-19-25-55(53)67(57(54)40-51)59-38-46(30-31-64-59)61(4,5)6;;/h12-38,41H,1-11H3;1H3;/q-3;-1;+4
• InChIKey: NQWXLIJHULWXBV-UHFFFAOYSA-N
• XLogP: 17.31
• TPSA: 33.53 Ų
• H-Bond Acceptors: 5
• Rotatable Bonds: 8
• Heavy Atoms: 70
• Complexity: —

Lipinski Rule of Five

2 violations

Rule	Value
MW ≤ 500	1100.32
LogP ≤ 5	17.31
H-Bond Donors ≤ 5	0
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-[3-[5-tert-butyl-3-[3-tert-butyl-5-(2-phenylpropan-2-yl)phenyl]-2H-benzimidazol-2-id-1-yl]-5-phenylbenzene-2-id-1-yl]oxy-9-(4-tert-butyl-2-pyridinyl)-1H-carbazol-1-ide;carbanide;platinum(4+)?

The IUPAC name of 2-[3-[5-tert-butyl-3-[3-tert-butyl-5-(2-phenylpropan-2-yl)phenyl]-2H-benzimidazol-2-id-1-yl]-5-phenylbenzene-2-id-1-yl]oxy-9-(4-tert-butyl-2-pyridinyl)-1H-carbazol-1-ide;carbanide;platinum(4+) (CID 162448067) is 2-[3-[5-tert-butyl-3-[3-tert-butyl-5-(2-phenylpropan-2-yl)phenyl]-2H-benzimidazol-2-id-1-yl]-5-phenylbenzene-2-id-1-yl]oxy-9-(4-tert-butyl-2-pyridinyl)-1H-carbazol-1-ide;carbanide;platinum(4+).

What is the SMILES notation for 2-[3-[5-tert-butyl-3-[3-tert-butyl-5-(2-phenylpropan-2-yl)phenyl]-2H-benzimidazol-2-id-1-yl]-5-phenylbenzene-2-id-1-yl]oxy-9-(4-tert-butyl-2-pyridinyl)-1H-carbazol-1-ide;carbanide;platinum(4+)?

The canonical SMILES for 2-[3-[5-tert-butyl-3-[3-tert-butyl-5-(2-phenylpropan-2-yl)phenyl]-2H-benzimidazol-2-id-1-yl]-5-phenylbenzene-2-id-1-yl]oxy-9-(4-tert-butyl-2-pyridinyl)-1H-carbazol-1-ide;carbanide;platinum(4+) is CC(C)(C)c1cc(N2[CH-]N(c3[c-]c(Oc4[c-]c5c(cc4)c4ccccc4n5-c4cc(C(C)(C)C)ccn4)cc(-c4ccccc4)c3)c3ccc(C(C)(C)C)cc32)cc(C(C)(C)c2ccccc2)c1.[CH3-].[Pt+4].

What is the InChIKey of 2-[3-[5-tert-butyl-3-[3-tert-butyl-5-(2-phenylpropan-2-yl)phenyl]-2H-benzimidazol-2-id-1-yl]-5-phenylbenzene-2-id-1-yl]oxy-9-(4-tert-butyl-2-pyridinyl)-1H-carbazol-1-ide;carbanide;platinum(4+)?

The InChIKey is NQWXLIJHULWXBV-UHFFFAOYSA-N. The full InChI is InChI=1S/C63H61N4O.CH3.Pt/c1-60(2,3)45-26-29-56-58(37-45)66(50-35-47(62(7,8)9)34-48(36-50)63(10,11)44-22-16-13-17-23-44)41-65(56)49-32-43(42-20-14-12-15-21-42)33-52(39-49)68-51-27-28-54-53-24-18-19-25-55(53)67(57(54)40-51)59-38-46(30-31-64-59)61(4,5)6;;/h12-38,41H,1-11H3;1H3;/q-3;-1;+4.

What are the key properties of 2-[3-[5-tert-butyl-3-[3-tert-butyl-5-(2-phenylpropan-2-yl)phenyl]-2H-benzimidazol-2-id-1-yl]-5-phenylbenzene-2-id-1-yl]oxy-9-(4-tert-butyl-2-pyridinyl)-1H-carbazol-1-ide;carbanide;platinum(4+)?

2-[3-[5-tert-butyl-3-[3-tert-butyl-5-(2-phenylpropan-2-yl)phenyl]-2H-benzimidazol-2-id-1-yl]-5-phenylbenzene-2-id-1-yl]oxy-9-(4-tert-butyl-2-pyridinyl)-1H-carbazol-1-ide;carbanide;platinum(4+) has a molecular weight of 1100.32 g/mol, XLogP of 17.31, 8 rotatable bonds, 0 hydrogen bond donors, and 5 hydrogen bond acceptors.

Where does this data come from?

All data for 2-[3-[5-tert-butyl-3-[3-tert-butyl-5-(2-phenylpropan-2-yl)phenyl]-2H-benzimidazol-2-id-1-yl]-5-phenylbenzene-2-id-1-yl]oxy-9-(4-tert-butyl-2-pyridinyl)-1H-carbazol-1-ide;carbanide;platinum(4+) is sourced from PubChem (CID 162448067), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).