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

C68H69N4OPt-3 — CID 162447425

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

4-tert-butyl-2-[3-[3-(3,5-ditert-butylphenyl)-4-(2-phenylpropan-2-yl)-2H-imidazol-2-id-1-yl]-5-phenylbenzene-2-id-1-yl]oxy-9-[4-(2-phenylpropan-2-yl)-2-pyridinyl]-1H-carbazol-1-ide;platinum (PubChem CID 162447425) has the molecular formula C68H69N4OPt-3 and a molecular weight of 1153.40 g/mol. Its IUPAC name is 4-tert-butyl-2-[3-[3-(3,5-ditert-butylphenyl)-4-(2-phenylpropan-2-yl)-2H-imidazol-2-id-1-yl]-5-phenylbenzene-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-[3-(3,5-ditert-butylphenyl)-4-(2-phenylpropan-2-yl)-2H-imidazol-2-id-1-yl]-5-phenylbenzene-2-id-1-yl]oxy-9-[4-(2-phenylpropan-2-yl)-2-pyridinyl]-1H-carbazol-1-ide;platinum
• PubChem CID: 162447425
• Molecular Formula: C68H69N4OPt-3
• Molecular Weight: 1153.40 g/mol
• Exact Mass: 1152.51
• IUPAC Name: 4-tert-butyl-2-[3-[3-(3,5-ditert-butylphenyl)-4-(2-phenylpropan-2-yl)-2H-imidazol-2-id-1-yl]-5-phenylbenzene-2-id-1-yl]oxy-9-[4-(2-phenylpropan-2-yl)-2-pyridinyl]-1H-carbazol-1-ide;platinum
• SMILES: CC(C)(C)c1cc(N2[CH-]N(c3[c-]c(Oc4[c-]c5c(c(C(C)(C)C)c4)c4ccccc4n5-c4cc(C(C)(C)c5ccccc5)ccn4)cc(-c4ccccc4)c3)C=C2C(C)(C)c2ccccc2)cc(C(C)(C)C)c1.[Pt]
• InChI: InChI=1S/C68H69N4O.Pt/c1-64(2,3)51-37-52(65(4,5)6)39-54(38-51)71-45-70(44-61(71)68(12,13)49-29-21-16-22-30-49)53-35-47(46-25-17-14-18-26-46)36-55(41-53)73-56-42-58(66(7,8)9)63-57-31-23-24-32-59(57)72(60(63)43-56)62-40-50(33-34-69-62)67(10,11)48-27-19-15-20-28-48;/h14-40,42,44-45H,1-13H3;/q-3
• InChIKey: RCCLLRUDMAZZNQ-UHFFFAOYSA-N
• XLogP: 17.72
• TPSA: 33.53 Ų
• H-Bond Acceptors: 5
• Rotatable Bonds: 10
• Heavy Atoms: 74
• Complexity: —

Lipinski Rule of Five

2 violations

Rule	Value
MW ≤ 500	1153.40
LogP ≤ 5	17.72
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 4-tert-butyl-2-[3-[3-(3,5-ditert-butylphenyl)-4-(2-phenylpropan-2-yl)-2H-imidazol-2-id-1-yl]-5-phenylbenzene-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-[3-(3,5-ditert-butylphenyl)-4-(2-phenylpropan-2-yl)-2H-imidazol-2-id-1-yl]-5-phenylbenzene-2-id-1-yl]oxy-9-[4-(2-phenylpropan-2-yl)-2-pyridinyl]-1H-carbazol-1-ide;platinum (CID 162447425) is 4-tert-butyl-2-[3-[3-(3,5-ditert-butylphenyl)-4-(2-phenylpropan-2-yl)-2H-imidazol-2-id-1-yl]-5-phenylbenzene-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-[3-(3,5-ditert-butylphenyl)-4-(2-phenylpropan-2-yl)-2H-imidazol-2-id-1-yl]-5-phenylbenzene-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-[3-(3,5-ditert-butylphenyl)-4-(2-phenylpropan-2-yl)-2H-imidazol-2-id-1-yl]-5-phenylbenzene-2-id-1-yl]oxy-9-[4-(2-phenylpropan-2-yl)-2-pyridinyl]-1H-carbazol-1-ide;platinum is CC(C)(C)c1cc(N2[CH-]N(c3[c-]c(Oc4[c-]c5c(c(C(C)(C)C)c4)c4ccccc4n5-c4cc(C(C)(C)c5ccccc5)ccn4)cc(-c4ccccc4)c3)C=C2C(C)(C)c2ccccc2)cc(C(C)(C)C)c1.[Pt].

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

The InChIKey is RCCLLRUDMAZZNQ-UHFFFAOYSA-N. The full InChI is InChI=1S/C68H69N4O.Pt/c1-64(2,3)51-37-52(65(4,5)6)39-54(38-51)71-45-70(44-61(71)68(12,13)49-29-21-16-22-30-49)53-35-47(46-25-17-14-18-26-46)36-55(41-53)73-56-42-58(66(7,8)9)63-57-31-23-24-32-59(57)72(60(63)43-56)62-40-50(33-34-69-62)67(10,11)48-27-19-15-20-28-48;/h14-40,42,44-45H,1-13H3;/q-3;.

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

4-tert-butyl-2-[3-[3-(3,5-ditert-butylphenyl)-4-(2-phenylpropan-2-yl)-2H-imidazol-2-id-1-yl]-5-phenylbenzene-2-id-1-yl]oxy-9-[4-(2-phenylpropan-2-yl)-2-pyridinyl]-1H-carbazol-1-ide;platinum has a molecular weight of 1153.40 g/mol, XLogP of 17.72, 10 rotatable bonds, 0 hydrogen bond donors, and 5 hydrogen bond acceptors.

Where does this data come from?

All data for 4-tert-butyl-2-[3-[3-(3,5-ditert-butylphenyl)-4-(2-phenylpropan-2-yl)-2H-imidazol-2-id-1-yl]-5-phenylbenzene-2-id-1-yl]oxy-9-[4-(2-phenylpropan-2-yl)-2-pyridinyl]-1H-carbazol-1-ide;platinum is sourced from PubChem (CID 162447425), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).