4-tert-butyl-2-[3-[4-tert-butyl-3-[3-tert-butyl-5-(2-phenylpropan-2-yl)phenyl]-2H-imidazol-3-ium-2-id-1-yl]benzene-2-id-1-yl]oxy-9-[4-(2-phenylpropan-2-yl)-2-pyridinyl]-1H-carbazol-1-ide;platinum

C62H64N4OPt-2 — CID 162447264

About 4-tert-butyl-2-[3-[4-tert-butyl-3-[3-tert-butyl-5-(2-phenylpropan-2-yl)phenyl]-2H-imidazol-3-ium-2-id-1-yl]benzene-2-id-1-yl]oxy-9-[4-(2-phenylpropan-2-yl)-2-pyridinyl]-1H-carbazol-1-ide;platinum

4-tert-butyl-2-[3-[4-tert-butyl-3-[3-tert-butyl-5-(2-phenylpropan-2-yl)phenyl]-2H-imidazol-3-ium-2-id-1-yl]benzene-2-id-1-yl]oxy-9-[4-(2-phenylpropan-2-yl)-2-pyridinyl]-1H-carbazol-1-ide;platinum (PubChem CID 162447264) has the molecular formula C62H64N4OPt-2 and a molecular weight of 1076.30 g/mol. Its IUPAC name is 4-tert-butyl-2-[3-[4-tert-butyl-3-[3-tert-butyl-5-(2-phenylpropan-2-yl)phenyl]-2H-imidazol-3-ium-2-id-1-yl]benzene-2-id-1-yl]oxy-9-[4-(2-phenylpropan-2-yl)-2-pyridinyl]-1H-carbazol-1-ide;platinum.

Molecular Properties

• Compound Name: 4-tert-butyl-2-[3-[4-tert-butyl-3-[3-tert-butyl-5-(2-phenylpropan-2-yl)phenyl]-2H-imidazol-3-ium-2-id-1-yl]benzene-2-id-1-yl]oxy-9-[4-(2-phenylpropan-2-yl)-2-pyridinyl]-1H-carbazol-1-ide;platinum
• PubChem CID: 162447264
• Molecular Formula: C62H64N4OPt-2
• Molecular Weight: 1076.30 g/mol
• Exact Mass: 1075.47
• IUPAC Name: 4-tert-butyl-2-[3-[4-tert-butyl-3-[3-tert-butyl-5-(2-phenylpropan-2-yl)phenyl]-2H-imidazol-3-ium-2-id-1-yl]benzene-2-id-1-yl]oxy-9-[4-(2-phenylpropan-2-yl)-2-pyridinyl]-1H-carbazol-1-ide;platinum
• SMILES: CC(C)(C)c1cc(-[n+]2[c-]n(-c3[c-]c(Oc4[c-]c5c(c(C(C)(C)C)c4)c4ccccc4n5-c4cc(C(C)(C)c5ccccc5)ccn4)ccc3)cc2C(C)(C)C)cc(C(C)(C)c2ccccc2)c1.[Pt]
• InChI: InChI=1S/C62H64N4O.Pt/c1-58(2,3)45-33-46(62(12,13)43-25-18-15-19-26-43)35-48(34-45)65-41-64(40-55(65)60(7,8)9)47-27-22-28-49(37-47)67-50-38-52(59(4,5)6)57-51-29-20-21-30-53(51)66(54(57)39-50)56-36-44(31-32-63-56)61(10,11)42-23-16-14-17-24-42;/h14-36,38,40H,1-13H3;/q-2
• InChIKey: FDHPQGALFDRUSM-UHFFFAOYSA-N
• XLogP: 14.98
• TPSA: 35.86 Ų
• H-Bond Acceptors: 4
• Rotatable Bonds: 9
• Heavy Atoms: 68
• Complexity: —

Lipinski Rule of Five

2 violations

Rule	Value
MW ≤ 500	1076.30
LogP ≤ 5	14.98
H-Bond Donors ≤ 5	0
H-Bond Acceptors ≤ 10	4

Computed Properties (RDKit)

• Structural Alerts: {'alert_name': 'Carbo_cation/anion', 'substructure': 'N/A'}, {'alert_name': 'quaternary_nitrogen_1', 'substructure': 'N/A'}

Frequently Asked Questions

What is the IUPAC name of 4-tert-butyl-2-[3-[4-tert-butyl-3-[3-tert-butyl-5-(2-phenylpropan-2-yl)phenyl]-2H-imidazol-3-ium-2-id-1-yl]benzene-2-id-1-yl]oxy-9-[4-(2-phenylpropan-2-yl)-2-pyridinyl]-1H-carbazol-1-ide;platinum?

The IUPAC name of 4-tert-butyl-2-[3-[4-tert-butyl-3-[3-tert-butyl-5-(2-phenylpropan-2-yl)phenyl]-2H-imidazol-3-ium-2-id-1-yl]benzene-2-id-1-yl]oxy-9-[4-(2-phenylpropan-2-yl)-2-pyridinyl]-1H-carbazol-1-ide;platinum (CID 162447264) is 4-tert-butyl-2-[3-[4-tert-butyl-3-[3-tert-butyl-5-(2-phenylpropan-2-yl)phenyl]-2H-imidazol-3-ium-2-id-1-yl]benzene-2-id-1-yl]oxy-9-[4-(2-phenylpropan-2-yl)-2-pyridinyl]-1H-carbazol-1-ide;platinum.

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

The canonical SMILES for 4-tert-butyl-2-[3-[4-tert-butyl-3-[3-tert-butyl-5-(2-phenylpropan-2-yl)phenyl]-2H-imidazol-3-ium-2-id-1-yl]benzene-2-id-1-yl]oxy-9-[4-(2-phenylpropan-2-yl)-2-pyridinyl]-1H-carbazol-1-ide;platinum is CC(C)(C)c1cc(-[n+]2[c-]n(-c3[c-]c(Oc4[c-]c5c(c(C(C)(C)C)c4)c4ccccc4n5-c4cc(C(C)(C)c5ccccc5)ccn4)ccc3)cc2C(C)(C)C)cc(C(C)(C)c2ccccc2)c1.[Pt].

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

The InChIKey is FDHPQGALFDRUSM-UHFFFAOYSA-N. The full InChI is InChI=1S/C62H64N4O.Pt/c1-58(2,3)45-33-46(62(12,13)43-25-18-15-19-26-43)35-48(34-45)65-41-64(40-55(65)60(7,8)9)47-27-22-28-49(37-47)67-50-38-52(59(4,5)6)57-51-29-20-21-30-53(51)66(54(57)39-50)56-36-44(31-32-63-56)61(10,11)42-23-16-14-17-24-42;/h14-36,38,40H,1-13H3;/q-2;.

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

4-tert-butyl-2-[3-[4-tert-butyl-3-[3-tert-butyl-5-(2-phenylpropan-2-yl)phenyl]-2H-imidazol-3-ium-2-id-1-yl]benzene-2-id-1-yl]oxy-9-[4-(2-phenylpropan-2-yl)-2-pyridinyl]-1H-carbazol-1-ide;platinum has a molecular weight of 1076.30 g/mol, XLogP of 14.98, 9 rotatable bonds, 0 hydrogen bond donors, and 4 hydrogen bond acceptors.

Where does this data come from?

All data for 4-tert-butyl-2-[3-[4-tert-butyl-3-[3-tert-butyl-5-(2-phenylpropan-2-yl)phenyl]-2H-imidazol-3-ium-2-id-1-yl]benzene-2-id-1-yl]oxy-9-[4-(2-phenylpropan-2-yl)-2-pyridinyl]-1H-carbazol-1-ide;platinum is sourced from PubChem (CID 162447264), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).