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

C62H65N4OPt-3 — CID 162447176

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

9-(4-tert-butyl-2-pyridinyl)-2-[3-[4,5-ditert-butyl-3-[4-(2-phenylpropan-2-yl)phenyl]-2H-imidazol-2-id-1-yl]-5-(2-propan-2-ylphenyl)benzene-2-id-1-yl]oxy-1H-carbazol-1-ide;platinum (PubChem CID 162447176) has the molecular formula C62H65N4OPt-3 and a molecular weight of 1077.31 g/mol. Its IUPAC name is 9-(4-tert-butyl-2-pyridinyl)-2-[3-[4,5-ditert-butyl-3-[4-(2-phenylpropan-2-yl)phenyl]-2H-imidazol-2-id-1-yl]-5-(2-propan-2-ylphenyl)benzene-2-id-1-yl]oxy-1H-carbazol-1-ide;platinum.

Molecular Properties

• Compound Name: 9-(4-tert-butyl-2-pyridinyl)-2-[3-[4,5-ditert-butyl-3-[4-(2-phenylpropan-2-yl)phenyl]-2H-imidazol-2-id-1-yl]-5-(2-propan-2-ylphenyl)benzene-2-id-1-yl]oxy-1H-carbazol-1-ide;platinum
• PubChem CID: 162447176
• Molecular Formula: C62H65N4OPt-3
• Molecular Weight: 1077.31 g/mol
• Exact Mass: 1076.48
• IUPAC Name: 9-(4-tert-butyl-2-pyridinyl)-2-[3-[4,5-ditert-butyl-3-[4-(2-phenylpropan-2-yl)phenyl]-2H-imidazol-2-id-1-yl]-5-(2-propan-2-ylphenyl)benzene-2-id-1-yl]oxy-1H-carbazol-1-ide;platinum
• SMILES: CC(C)c1ccccc1-c1cc(Oc2[c-]c3c(cc2)c2ccccc2n3-c2cc(C(C)(C)C)ccn2)[c-]c(N2[CH-]N(c3ccc(C(C)(C)c4ccccc4)cc3)C(C(C)(C)C)=C2C(C)(C)C)c1.[Pt]
• InChI: InChI=1S/C62H65N4O.Pt/c1-41(2)50-23-17-18-24-51(50)42-35-47(65-40-64(57(60(6,7)8)58(65)61(9,10)11)46-29-27-44(28-30-46)62(12,13)43-21-15-14-16-22-43)38-49(36-42)67-48-31-32-53-52-25-19-20-26-54(52)66(55(53)39-48)56-37-45(33-34-63-56)59(3,4)5;/h14-37,40-41H,1-13H3;/q-3
• InChIKey: SBUAHEOUGGHLRG-UHFFFAOYSA-N
• XLogP: 16.73
• TPSA: 33.53 Ų
• H-Bond Acceptors: 5
• Rotatable Bonds: 9
• Heavy Atoms: 68
• Complexity: —

Lipinski Rule of Five

2 violations

Rule	Value
MW ≤ 500	1077.31
LogP ≤ 5	16.73
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 9-(4-tert-butyl-2-pyridinyl)-2-[3-[4,5-ditert-butyl-3-[4-(2-phenylpropan-2-yl)phenyl]-2H-imidazol-2-id-1-yl]-5-(2-propan-2-ylphenyl)benzene-2-id-1-yl]oxy-1H-carbazol-1-ide;platinum?

The IUPAC name of 9-(4-tert-butyl-2-pyridinyl)-2-[3-[4,5-ditert-butyl-3-[4-(2-phenylpropan-2-yl)phenyl]-2H-imidazol-2-id-1-yl]-5-(2-propan-2-ylphenyl)benzene-2-id-1-yl]oxy-1H-carbazol-1-ide;platinum (CID 162447176) is 9-(4-tert-butyl-2-pyridinyl)-2-[3-[4,5-ditert-butyl-3-[4-(2-phenylpropan-2-yl)phenyl]-2H-imidazol-2-id-1-yl]-5-(2-propan-2-ylphenyl)benzene-2-id-1-yl]oxy-1H-carbazol-1-ide;platinum.

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

The canonical SMILES for 9-(4-tert-butyl-2-pyridinyl)-2-[3-[4,5-ditert-butyl-3-[4-(2-phenylpropan-2-yl)phenyl]-2H-imidazol-2-id-1-yl]-5-(2-propan-2-ylphenyl)benzene-2-id-1-yl]oxy-1H-carbazol-1-ide;platinum is CC(C)c1ccccc1-c1cc(Oc2[c-]c3c(cc2)c2ccccc2n3-c2cc(C(C)(C)C)ccn2)[c-]c(N2[CH-]N(c3ccc(C(C)(C)c4ccccc4)cc3)C(C(C)(C)C)=C2C(C)(C)C)c1.[Pt].

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

The InChIKey is SBUAHEOUGGHLRG-UHFFFAOYSA-N. The full InChI is InChI=1S/C62H65N4O.Pt/c1-41(2)50-23-17-18-24-51(50)42-35-47(65-40-64(57(60(6,7)8)58(65)61(9,10)11)46-29-27-44(28-30-46)62(12,13)43-21-15-14-16-22-43)38-49(36-42)67-48-31-32-53-52-25-19-20-26-54(52)66(55(53)39-48)56-37-45(33-34-63-56)59(3,4)5;/h14-37,40-41H,1-13H3;/q-3;.

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

9-(4-tert-butyl-2-pyridinyl)-2-[3-[4,5-ditert-butyl-3-[4-(2-phenylpropan-2-yl)phenyl]-2H-imidazol-2-id-1-yl]-5-(2-propan-2-ylphenyl)benzene-2-id-1-yl]oxy-1H-carbazol-1-ide;platinum has a molecular weight of 1077.31 g/mol, XLogP of 16.73, 9 rotatable bonds, 0 hydrogen bond donors, and 5 hydrogen bond acceptors.

Where does this data come from?

All data for 9-(4-tert-butyl-2-pyridinyl)-2-[3-[4,5-ditert-butyl-3-[4-(2-phenylpropan-2-yl)phenyl]-2H-imidazol-2-id-1-yl]-5-(2-propan-2-ylphenyl)benzene-2-id-1-yl]oxy-1H-carbazol-1-ide;platinum is sourced from PubChem (CID 162447176), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).