2-[3-[6-tert-butyl-3-[3-phenyl-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+)

C66H60N4OPt — CID 162448124

About 2-[3-[6-tert-butyl-3-[3-phenyl-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-[6-tert-butyl-3-[3-phenyl-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 162448124) has the molecular formula C66H60N4OPt and a molecular weight of 1120.31 g/mol. Its IUPAC name is 2-[3-[6-tert-butyl-3-[3-phenyl-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-[6-tert-butyl-3-[3-phenyl-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: 162448124
• Molecular Formula: C66H60N4OPt
• Molecular Weight: 1120.31 g/mol
• Exact Mass: 1119.44
• IUPAC Name: 2-[3-[6-tert-butyl-3-[3-phenyl-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)c1ccnc(-n2c3[c-]c(Oc4[c-]c(N5[CH-]N(c6cc(-c7ccccc7)cc(C(C)(C)c7ccccc7)c6)c6ccc(C(C)(C)C)cc65)cc(-c5ccccc5)c4)ccc3c3ccccc32)c1.[CH3-].[Pt+4]
• InChI: InChI=1S/C65H57N4O.CH3.Pt/c1-63(2,3)49-28-31-59-61(39-49)68(43-67(59)52-35-46(44-20-12-9-13-21-44)34-51(38-52)65(7,8)48-24-16-11-17-25-48)53-36-47(45-22-14-10-15-23-45)37-55(41-53)70-54-29-30-57-56-26-18-19-27-58(56)69(60(57)42-54)62-40-50(32-33-66-62)64(4,5)6;;/h9-40,43H,1-8H3;1H3;/q-3;-1;+4
• InChIKey: FUQQGMZMKCLGAZ-UHFFFAOYSA-N
• XLogP: 17.68
• TPSA: 33.53 Ų
• H-Bond Acceptors: 5
• Rotatable Bonds: 9
• Heavy Atoms: 72
• Complexity: —

Lipinski Rule of Five

2 violations

Rule	Value
MW ≤ 500	1120.31
LogP ≤ 5	17.68
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-[6-tert-butyl-3-[3-phenyl-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-[6-tert-butyl-3-[3-phenyl-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 162448124) is 2-[3-[6-tert-butyl-3-[3-phenyl-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-[6-tert-butyl-3-[3-phenyl-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-[6-tert-butyl-3-[3-phenyl-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)c1ccnc(-n2c3[c-]c(Oc4[c-]c(N5[CH-]N(c6cc(-c7ccccc7)cc(C(C)(C)c7ccccc7)c6)c6ccc(C(C)(C)C)cc65)cc(-c5ccccc5)c4)ccc3c3ccccc32)c1.[CH3-].[Pt+4].

What is the InChIKey of 2-[3-[6-tert-butyl-3-[3-phenyl-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 FUQQGMZMKCLGAZ-UHFFFAOYSA-N. The full InChI is InChI=1S/C65H57N4O.CH3.Pt/c1-63(2,3)49-28-31-59-61(39-49)68(43-67(59)52-35-46(44-20-12-9-13-21-44)34-51(38-52)65(7,8)48-24-16-11-17-25-48)53-36-47(45-22-14-10-15-23-45)37-55(41-53)70-54-29-30-57-56-26-18-19-27-58(56)69(60(57)42-54)62-40-50(32-33-66-62)64(4,5)6;;/h9-40,43H,1-8H3;1H3;/q-3;-1;+4.

What are the key properties of 2-[3-[6-tert-butyl-3-[3-phenyl-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-[6-tert-butyl-3-[3-phenyl-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 1120.31 g/mol, XLogP of 17.68, 9 rotatable bonds, 0 hydrogen bond donors, and 5 hydrogen bond acceptors.

Where does this data come from?

All data for 2-[3-[6-tert-butyl-3-[3-phenyl-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 162448124), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).