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

C58H56N4OPt-2 — CID 162449109

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

4-tert-butyl-9-(4-tert-butyl-2-pyridinyl)-2-[3-[4-(2-phenylpropan-2-yl)-3-[3-(2-phenylpropan-2-yl)phenyl]-2H-imidazol-3-ium-2-id-1-yl]benzene-2-id-1-yl]oxy-1H-carbazol-1-ide;platinum (PubChem CID 162449109) has the molecular formula C58H56N4OPt-2 and a molecular weight of 1020.19 g/mol. Its IUPAC name is 4-tert-butyl-9-(4-tert-butyl-2-pyridinyl)-2-[3-[4-(2-phenylpropan-2-yl)-3-[3-(2-phenylpropan-2-yl)phenyl]-2H-imidazol-3-ium-2-id-1-yl]benzene-2-id-1-yl]oxy-1H-carbazol-1-ide;platinum.

Molecular Properties

• Compound Name: 4-tert-butyl-9-(4-tert-butyl-2-pyridinyl)-2-[3-[4-(2-phenylpropan-2-yl)-3-[3-(2-phenylpropan-2-yl)phenyl]-2H-imidazol-3-ium-2-id-1-yl]benzene-2-id-1-yl]oxy-1H-carbazol-1-ide;platinum
• PubChem CID: 162449109
• Molecular Formula: C58H56N4OPt-2
• Molecular Weight: 1020.19 g/mol
• Exact Mass: 1019.41
• IUPAC Name: 4-tert-butyl-9-(4-tert-butyl-2-pyridinyl)-2-[3-[4-(2-phenylpropan-2-yl)-3-[3-(2-phenylpropan-2-yl)phenyl]-2H-imidazol-3-ium-2-id-1-yl]benzene-2-id-1-yl]oxy-1H-carbazol-1-ide;platinum
• SMILES: CC(C)(C)c1ccnc(-n2c3[c-]c(Oc4[c-]c(-n5[c-][n+](-c6cccc(C(C)(C)c7ccccc7)c6)c(C(C)(C)c6ccccc6)c5)ccc4)cc(C(C)(C)C)c3c3ccccc32)c1.[Pt]
• InChI: InChI=1S/C58H56N4O.Pt/c1-55(2,3)42-31-32-59-53(34-42)62-50-30-18-17-29-48(50)54-49(56(4,5)6)36-47(37-51(54)62)63-46-28-20-26-44(35-46)60-38-52(58(9,10)41-23-15-12-16-24-41)61(39-60)45-27-19-25-43(33-45)57(7,8)40-21-13-11-14-22-40;/h11-34,36,38H,1-10H3;/q-2
• InChIKey: WZWDXARXQBLSGW-UHFFFAOYSA-N
• XLogP: 13.68
• TPSA: 35.86 Ų
• H-Bond Acceptors: 4
• Rotatable Bonds: 9
• Heavy Atoms: 64
• Complexity: —

Lipinski Rule of Five

2 violations

Rule	Value
MW ≤ 500	1020.19
LogP ≤ 5	13.68
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-9-(4-tert-butyl-2-pyridinyl)-2-[3-[4-(2-phenylpropan-2-yl)-3-[3-(2-phenylpropan-2-yl)phenyl]-2H-imidazol-3-ium-2-id-1-yl]benzene-2-id-1-yl]oxy-1H-carbazol-1-ide;platinum?

The IUPAC name of 4-tert-butyl-9-(4-tert-butyl-2-pyridinyl)-2-[3-[4-(2-phenylpropan-2-yl)-3-[3-(2-phenylpropan-2-yl)phenyl]-2H-imidazol-3-ium-2-id-1-yl]benzene-2-id-1-yl]oxy-1H-carbazol-1-ide;platinum (CID 162449109) is 4-tert-butyl-9-(4-tert-butyl-2-pyridinyl)-2-[3-[4-(2-phenylpropan-2-yl)-3-[3-(2-phenylpropan-2-yl)phenyl]-2H-imidazol-3-ium-2-id-1-yl]benzene-2-id-1-yl]oxy-1H-carbazol-1-ide;platinum.

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

The canonical SMILES for 4-tert-butyl-9-(4-tert-butyl-2-pyridinyl)-2-[3-[4-(2-phenylpropan-2-yl)-3-[3-(2-phenylpropan-2-yl)phenyl]-2H-imidazol-3-ium-2-id-1-yl]benzene-2-id-1-yl]oxy-1H-carbazol-1-ide;platinum is CC(C)(C)c1ccnc(-n2c3[c-]c(Oc4[c-]c(-n5[c-][n+](-c6cccc(C(C)(C)c7ccccc7)c6)c(C(C)(C)c6ccccc6)c5)ccc4)cc(C(C)(C)C)c3c3ccccc32)c1.[Pt].

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

The InChIKey is WZWDXARXQBLSGW-UHFFFAOYSA-N. The full InChI is InChI=1S/C58H56N4O.Pt/c1-55(2,3)42-31-32-59-53(34-42)62-50-30-18-17-29-48(50)54-49(56(4,5)6)36-47(37-51(54)62)63-46-28-20-26-44(35-46)60-38-52(58(9,10)41-23-15-12-16-24-41)61(39-60)45-27-19-25-43(33-45)57(7,8)40-21-13-11-14-22-40;/h11-34,36,38H,1-10H3;/q-2;.

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

4-tert-butyl-9-(4-tert-butyl-2-pyridinyl)-2-[3-[4-(2-phenylpropan-2-yl)-3-[3-(2-phenylpropan-2-yl)phenyl]-2H-imidazol-3-ium-2-id-1-yl]benzene-2-id-1-yl]oxy-1H-carbazol-1-ide;platinum has a molecular weight of 1020.19 g/mol, XLogP of 13.68, 9 rotatable bonds, 0 hydrogen bond donors, and 4 hydrogen bond acceptors.

Where does this data come from?

All data for 4-tert-butyl-9-(4-tert-butyl-2-pyridinyl)-2-[3-[4-(2-phenylpropan-2-yl)-3-[3-(2-phenylpropan-2-yl)phenyl]-2H-imidazol-3-ium-2-id-1-yl]benzene-2-id-1-yl]oxy-1H-carbazol-1-ide;platinum is sourced from PubChem (CID 162449109), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).