2-[3-[4-tert-butyl-3-(4-tert-butylphenyl)-2H-imidazol-2-id-1-yl]-5-(2-phenylpropan-2-yl)benzene-2-id-1-yl]oxy-6-phenyl-9-[4-(2-phenylpropan-2-yl)-2-pyridinyl]-1H-carbazol-1-ide;platinum

C64H61N4OPt-3 — CID 162449839

About 2-[3-[4-tert-butyl-3-(4-tert-butylphenyl)-2H-imidazol-2-id-1-yl]-5-(2-phenylpropan-2-yl)benzene-2-id-1-yl]oxy-6-phenyl-9-[4-(2-phenylpropan-2-yl)-2-pyridinyl]-1H-carbazol-1-ide;platinum

2-[3-[4-tert-butyl-3-(4-tert-butylphenyl)-2H-imidazol-2-id-1-yl]-5-(2-phenylpropan-2-yl)benzene-2-id-1-yl]oxy-6-phenyl-9-[4-(2-phenylpropan-2-yl)-2-pyridinyl]-1H-carbazol-1-ide;platinum (PubChem CID 162449839) has the molecular formula C64H61N4OPt-3 and a molecular weight of 1097.30 g/mol. Its IUPAC name is 2-[3-[4-tert-butyl-3-(4-tert-butylphenyl)-2H-imidazol-2-id-1-yl]-5-(2-phenylpropan-2-yl)benzene-2-id-1-yl]oxy-6-phenyl-9-[4-(2-phenylpropan-2-yl)-2-pyridinyl]-1H-carbazol-1-ide;platinum.

Molecular Properties

• Compound Name: 2-[3-[4-tert-butyl-3-(4-tert-butylphenyl)-2H-imidazol-2-id-1-yl]-5-(2-phenylpropan-2-yl)benzene-2-id-1-yl]oxy-6-phenyl-9-[4-(2-phenylpropan-2-yl)-2-pyridinyl]-1H-carbazol-1-ide;platinum
• PubChem CID: 162449839
• Molecular Formula: C64H61N4OPt-3
• Molecular Weight: 1097.30 g/mol
• Exact Mass: 1096.45
• IUPAC Name: 2-[3-[4-tert-butyl-3-(4-tert-butylphenyl)-2H-imidazol-2-id-1-yl]-5-(2-phenylpropan-2-yl)benzene-2-id-1-yl]oxy-6-phenyl-9-[4-(2-phenylpropan-2-yl)-2-pyridinyl]-1H-carbazol-1-ide;platinum
• SMILES: CC(C)(C)C1=CN(c2[c-]c(Oc3[c-]c4c(cc3)c3cc(-c5ccccc5)ccc3n4-c3cc(C(C)(C)c4ccccc4)ccn3)cc(C(C)(C)c3ccccc3)c2)[CH-]N1c1ccc(C(C)(C)C)cc1.[Pt]
• InChI: InChI=1S/C64H61N4O.Pt/c1-61(2,3)46-27-29-51(30-28-46)67-43-66(42-59(67)62(4,5)6)52-37-50(64(9,10)48-24-18-13-19-25-48)38-54(40-52)69-53-31-32-55-56-36-45(44-20-14-11-15-21-44)26-33-57(56)68(58(55)41-53)60-39-49(34-35-65-60)63(7,8)47-22-16-12-17-23-47;/h11-39,42-43H,1-10H3;/q-3
• InChIKey: DMWXHGHVYQFKGS-UHFFFAOYSA-N
• XLogP: 16.52
• TPSA: 33.53 Ų
• H-Bond Acceptors: 5
• Rotatable Bonds: 10
• Heavy Atoms: 70
• Complexity: —

Lipinski Rule of Five

2 violations

Rule	Value
MW ≤ 500	1097.30
LogP ≤ 5	16.52
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-[4-tert-butyl-3-(4-tert-butylphenyl)-2H-imidazol-2-id-1-yl]-5-(2-phenylpropan-2-yl)benzene-2-id-1-yl]oxy-6-phenyl-9-[4-(2-phenylpropan-2-yl)-2-pyridinyl]-1H-carbazol-1-ide;platinum?

The IUPAC name of 2-[3-[4-tert-butyl-3-(4-tert-butylphenyl)-2H-imidazol-2-id-1-yl]-5-(2-phenylpropan-2-yl)benzene-2-id-1-yl]oxy-6-phenyl-9-[4-(2-phenylpropan-2-yl)-2-pyridinyl]-1H-carbazol-1-ide;platinum (CID 162449839) is 2-[3-[4-tert-butyl-3-(4-tert-butylphenyl)-2H-imidazol-2-id-1-yl]-5-(2-phenylpropan-2-yl)benzene-2-id-1-yl]oxy-6-phenyl-9-[4-(2-phenylpropan-2-yl)-2-pyridinyl]-1H-carbazol-1-ide;platinum.

What is the SMILES notation for 2-[3-[4-tert-butyl-3-(4-tert-butylphenyl)-2H-imidazol-2-id-1-yl]-5-(2-phenylpropan-2-yl)benzene-2-id-1-yl]oxy-6-phenyl-9-[4-(2-phenylpropan-2-yl)-2-pyridinyl]-1H-carbazol-1-ide;platinum?

The canonical SMILES for 2-[3-[4-tert-butyl-3-(4-tert-butylphenyl)-2H-imidazol-2-id-1-yl]-5-(2-phenylpropan-2-yl)benzene-2-id-1-yl]oxy-6-phenyl-9-[4-(2-phenylpropan-2-yl)-2-pyridinyl]-1H-carbazol-1-ide;platinum is CC(C)(C)C1=CN(c2[c-]c(Oc3[c-]c4c(cc3)c3cc(-c5ccccc5)ccc3n4-c3cc(C(C)(C)c4ccccc4)ccn3)cc(C(C)(C)c3ccccc3)c2)[CH-]N1c1ccc(C(C)(C)C)cc1.[Pt].

What is the InChIKey of 2-[3-[4-tert-butyl-3-(4-tert-butylphenyl)-2H-imidazol-2-id-1-yl]-5-(2-phenylpropan-2-yl)benzene-2-id-1-yl]oxy-6-phenyl-9-[4-(2-phenylpropan-2-yl)-2-pyridinyl]-1H-carbazol-1-ide;platinum?

The InChIKey is DMWXHGHVYQFKGS-UHFFFAOYSA-N. The full InChI is InChI=1S/C64H61N4O.Pt/c1-61(2,3)46-27-29-51(30-28-46)67-43-66(42-59(67)62(4,5)6)52-37-50(64(9,10)48-24-18-13-19-25-48)38-54(40-52)69-53-31-32-55-56-36-45(44-20-14-11-15-21-44)26-33-57(56)68(58(55)41-53)60-39-49(34-35-65-60)63(7,8)47-22-16-12-17-23-47;/h11-39,42-43H,1-10H3;/q-3;.

What are the key properties of 2-[3-[4-tert-butyl-3-(4-tert-butylphenyl)-2H-imidazol-2-id-1-yl]-5-(2-phenylpropan-2-yl)benzene-2-id-1-yl]oxy-6-phenyl-9-[4-(2-phenylpropan-2-yl)-2-pyridinyl]-1H-carbazol-1-ide;platinum?

2-[3-[4-tert-butyl-3-(4-tert-butylphenyl)-2H-imidazol-2-id-1-yl]-5-(2-phenylpropan-2-yl)benzene-2-id-1-yl]oxy-6-phenyl-9-[4-(2-phenylpropan-2-yl)-2-pyridinyl]-1H-carbazol-1-ide;platinum has a molecular weight of 1097.30 g/mol, XLogP of 16.52, 10 rotatable bonds, 0 hydrogen bond donors, and 5 hydrogen bond acceptors.

Where does this data come from?

All data for 2-[3-[4-tert-butyl-3-(4-tert-butylphenyl)-2H-imidazol-2-id-1-yl]-5-(2-phenylpropan-2-yl)benzene-2-id-1-yl]oxy-6-phenyl-9-[4-(2-phenylpropan-2-yl)-2-pyridinyl]-1H-carbazol-1-ide;platinum is sourced from PubChem (CID 162449839), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).