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

C68H68N4OPt-2 — CID 162447391

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

2-[3-tert-butyl-5-[3-(3-tert-butyl-5-phenylphenyl)-4-(2-phenylpropan-2-yl)-2H-imidazol-3-ium-2-id-1-yl]benzene-6-id-1-yl]oxy-9-(4-tert-butyl-2-pyridinyl)-4-(2-phenylpropan-2-yl)-1H-carbazol-1-ide;platinum (PubChem CID 162447391) has the molecular formula C68H68N4OPt-2 and a molecular weight of 1152.40 g/mol. Its IUPAC name is 2-[3-tert-butyl-5-[3-(3-tert-butyl-5-phenylphenyl)-4-(2-phenylpropan-2-yl)-2H-imidazol-3-ium-2-id-1-yl]benzene-6-id-1-yl]oxy-9-(4-tert-butyl-2-pyridinyl)-4-(2-phenylpropan-2-yl)-1H-carbazol-1-ide;platinum.

Molecular Properties

• Compound Name: 2-[3-tert-butyl-5-[3-(3-tert-butyl-5-phenylphenyl)-4-(2-phenylpropan-2-yl)-2H-imidazol-3-ium-2-id-1-yl]benzene-6-id-1-yl]oxy-9-(4-tert-butyl-2-pyridinyl)-4-(2-phenylpropan-2-yl)-1H-carbazol-1-ide;platinum
• PubChem CID: 162447391
• Molecular Formula: C68H68N4OPt-2
• Molecular Weight: 1152.40 g/mol
• Exact Mass: 1151.51
• IUPAC Name: 2-[3-tert-butyl-5-[3-(3-tert-butyl-5-phenylphenyl)-4-(2-phenylpropan-2-yl)-2H-imidazol-3-ium-2-id-1-yl]benzene-6-id-1-yl]oxy-9-(4-tert-butyl-2-pyridinyl)-4-(2-phenylpropan-2-yl)-1H-carbazol-1-ide;platinum
• SMILES: CC(C)(C)c1cc(Oc2[c-]c3c(c(C(C)(C)c4ccccc4)c2)c2ccccc2n3-c2cc(C(C)(C)C)ccn2)[c-]c(-n2[c-][n+](-c3cc(-c4ccccc4)cc(C(C)(C)C)c3)c(C(C)(C)c3ccccc3)c2)c1.[Pt]
• InChI: InChI=1S/C68H68N4O.Pt/c1-64(2,3)50-33-34-69-62(40-50)72-59-32-24-23-31-57(59)63-58(67(10,11)48-27-19-15-20-28-48)42-56(43-60(63)72)73-55-39-52(66(7,8)9)37-53(41-55)70-44-61(68(12,13)49-29-21-16-22-30-49)71(45-70)54-36-47(46-25-17-14-18-26-46)35-51(38-54)65(4,5)6;/h14-40,42,44H,1-13H3;/q-2
• InChIKey: QFWZODRNKHZDMW-UHFFFAOYSA-N
• XLogP: 16.65
• TPSA: 35.86 Ų
• H-Bond Acceptors: 4
• Rotatable Bonds: 10
• Heavy Atoms: 74
• Complexity: —

Lipinski Rule of Five

2 violations

Rule	Value
MW ≤ 500	1152.40
LogP ≤ 5	16.65
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 2-[3-tert-butyl-5-[3-(3-tert-butyl-5-phenylphenyl)-4-(2-phenylpropan-2-yl)-2H-imidazol-3-ium-2-id-1-yl]benzene-6-id-1-yl]oxy-9-(4-tert-butyl-2-pyridinyl)-4-(2-phenylpropan-2-yl)-1H-carbazol-1-ide;platinum?

The IUPAC name of 2-[3-tert-butyl-5-[3-(3-tert-butyl-5-phenylphenyl)-4-(2-phenylpropan-2-yl)-2H-imidazol-3-ium-2-id-1-yl]benzene-6-id-1-yl]oxy-9-(4-tert-butyl-2-pyridinyl)-4-(2-phenylpropan-2-yl)-1H-carbazol-1-ide;platinum (CID 162447391) is 2-[3-tert-butyl-5-[3-(3-tert-butyl-5-phenylphenyl)-4-(2-phenylpropan-2-yl)-2H-imidazol-3-ium-2-id-1-yl]benzene-6-id-1-yl]oxy-9-(4-tert-butyl-2-pyridinyl)-4-(2-phenylpropan-2-yl)-1H-carbazol-1-ide;platinum.

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

The canonical SMILES for 2-[3-tert-butyl-5-[3-(3-tert-butyl-5-phenylphenyl)-4-(2-phenylpropan-2-yl)-2H-imidazol-3-ium-2-id-1-yl]benzene-6-id-1-yl]oxy-9-(4-tert-butyl-2-pyridinyl)-4-(2-phenylpropan-2-yl)-1H-carbazol-1-ide;platinum is CC(C)(C)c1cc(Oc2[c-]c3c(c(C(C)(C)c4ccccc4)c2)c2ccccc2n3-c2cc(C(C)(C)C)ccn2)[c-]c(-n2[c-][n+](-c3cc(-c4ccccc4)cc(C(C)(C)C)c3)c(C(C)(C)c3ccccc3)c2)c1.[Pt].

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

The InChIKey is QFWZODRNKHZDMW-UHFFFAOYSA-N. The full InChI is InChI=1S/C68H68N4O.Pt/c1-64(2,3)50-33-34-69-62(40-50)72-59-32-24-23-31-57(59)63-58(67(10,11)48-27-19-15-20-28-48)42-56(43-60(63)72)73-55-39-52(66(7,8)9)37-53(41-55)70-44-61(68(12,13)49-29-21-16-22-30-49)71(45-70)54-36-47(46-25-17-14-18-26-46)35-51(38-54)65(4,5)6;/h14-40,42,44H,1-13H3;/q-2;.

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

2-[3-tert-butyl-5-[3-(3-tert-butyl-5-phenylphenyl)-4-(2-phenylpropan-2-yl)-2H-imidazol-3-ium-2-id-1-yl]benzene-6-id-1-yl]oxy-9-(4-tert-butyl-2-pyridinyl)-4-(2-phenylpropan-2-yl)-1H-carbazol-1-ide;platinum has a molecular weight of 1152.40 g/mol, XLogP of 16.65, 10 rotatable bonds, 0 hydrogen bond donors, and 4 hydrogen bond acceptors.

Where does this data come from?

All data for 2-[3-tert-butyl-5-[3-(3-tert-butyl-5-phenylphenyl)-4-(2-phenylpropan-2-yl)-2H-imidazol-3-ium-2-id-1-yl]benzene-6-id-1-yl]oxy-9-(4-tert-butyl-2-pyridinyl)-4-(2-phenylpropan-2-yl)-1H-carbazol-1-ide;platinum is sourced from PubChem (CID 162447391), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).