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

C72H69N4OPt-3 — CID 162448885

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

2-[3-[3-(3-tert-butyl-5-phenylphenyl)-5-[2,6-di(propan-2-yl)phenyl]-2H-imidazol-2-id-1-yl]benzene-2-id-1-yl]oxy-4-(2-phenylpropan-2-yl)-9-[4-(2-phenylpropan-2-yl)-2-pyridinyl]-1H-carbazol-1-ide;platinum (PubChem CID 162448885) has the molecular formula C72H69N4OPt-3 and a molecular weight of 1201.45 g/mol. Its IUPAC name is 2-[3-[3-(3-tert-butyl-5-phenylphenyl)-5-[2,6-di(propan-2-yl)phenyl]-2H-imidazol-2-id-1-yl]benzene-2-id-1-yl]oxy-4-(2-phenylpropan-2-yl)-9-[4-(2-phenylpropan-2-yl)-2-pyridinyl]-1H-carbazol-1-ide;platinum.

Molecular Properties

• Compound Name: 2-[3-[3-(3-tert-butyl-5-phenylphenyl)-5-[2,6-di(propan-2-yl)phenyl]-2H-imidazol-2-id-1-yl]benzene-2-id-1-yl]oxy-4-(2-phenylpropan-2-yl)-9-[4-(2-phenylpropan-2-yl)-2-pyridinyl]-1H-carbazol-1-ide;platinum
• PubChem CID: 162448885
• Molecular Formula: C72H69N4OPt-3
• Molecular Weight: 1201.45 g/mol
• Exact Mass: 1200.51
• IUPAC Name: 2-[3-[3-(3-tert-butyl-5-phenylphenyl)-5-[2,6-di(propan-2-yl)phenyl]-2H-imidazol-2-id-1-yl]benzene-2-id-1-yl]oxy-4-(2-phenylpropan-2-yl)-9-[4-(2-phenylpropan-2-yl)-2-pyridinyl]-1H-carbazol-1-ide;platinum
• SMILES: CC(C)c1cccc(C(C)C)c1C1=CN(c2cc(-c3ccccc3)cc(C(C)(C)C)c2)[CH-]N1c1[c-]c(Oc2[c-]c3c(c(C(C)(C)c4ccccc4)c2)c2ccccc2n3-c2cc(C(C)(C)c3ccccc3)ccn2)ccc1.[Pt]
• InChI: InChI=1S/C72H69N4O.Pt/c1-48(2)60-34-24-35-61(49(3)4)68(60)66-46-74(57-40-51(50-25-15-12-16-26-50)39-55(41-57)70(5,6)7)47-75(66)56-31-23-32-58(43-56)77-59-44-63(72(10,11)53-29-19-14-20-30-53)69-62-33-21-22-36-64(62)76(65(69)45-59)67-42-54(37-38-73-67)71(8,9)52-27-17-13-18-28-52;/h12-42,44,46-49H,1-11H3;/q-3
• InChIKey: WOEPCVNRLDDVHM-UHFFFAOYSA-N
• XLogP: 18.88
• TPSA: 33.53 Ų
• H-Bond Acceptors: 5
• Rotatable Bonds: 13
• Heavy Atoms: 78
• Complexity: —

Lipinski Rule of Five

2 violations

Rule	Value
MW ≤ 500	1201.45
LogP ≤ 5	18.88
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-[3-(3-tert-butyl-5-phenylphenyl)-5-[2,6-di(propan-2-yl)phenyl]-2H-imidazol-2-id-1-yl]benzene-2-id-1-yl]oxy-4-(2-phenylpropan-2-yl)-9-[4-(2-phenylpropan-2-yl)-2-pyridinyl]-1H-carbazol-1-ide;platinum?

The IUPAC name of 2-[3-[3-(3-tert-butyl-5-phenylphenyl)-5-[2,6-di(propan-2-yl)phenyl]-2H-imidazol-2-id-1-yl]benzene-2-id-1-yl]oxy-4-(2-phenylpropan-2-yl)-9-[4-(2-phenylpropan-2-yl)-2-pyridinyl]-1H-carbazol-1-ide;platinum (CID 162448885) is 2-[3-[3-(3-tert-butyl-5-phenylphenyl)-5-[2,6-di(propan-2-yl)phenyl]-2H-imidazol-2-id-1-yl]benzene-2-id-1-yl]oxy-4-(2-phenylpropan-2-yl)-9-[4-(2-phenylpropan-2-yl)-2-pyridinyl]-1H-carbazol-1-ide;platinum.

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

The canonical SMILES for 2-[3-[3-(3-tert-butyl-5-phenylphenyl)-5-[2,6-di(propan-2-yl)phenyl]-2H-imidazol-2-id-1-yl]benzene-2-id-1-yl]oxy-4-(2-phenylpropan-2-yl)-9-[4-(2-phenylpropan-2-yl)-2-pyridinyl]-1H-carbazol-1-ide;platinum is CC(C)c1cccc(C(C)C)c1C1=CN(c2cc(-c3ccccc3)cc(C(C)(C)C)c2)[CH-]N1c1[c-]c(Oc2[c-]c3c(c(C(C)(C)c4ccccc4)c2)c2ccccc2n3-c2cc(C(C)(C)c3ccccc3)ccn2)ccc1.[Pt].

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

The InChIKey is WOEPCVNRLDDVHM-UHFFFAOYSA-N. The full InChI is InChI=1S/C72H69N4O.Pt/c1-48(2)60-34-24-35-61(49(3)4)68(60)66-46-74(57-40-51(50-25-15-12-16-26-50)39-55(41-57)70(5,6)7)47-75(66)56-31-23-32-58(43-56)77-59-44-63(72(10,11)53-29-19-14-20-30-53)69-62-33-21-22-36-64(62)76(65(69)45-59)67-42-54(37-38-73-67)71(8,9)52-27-17-13-18-28-52;/h12-42,44,46-49H,1-11H3;/q-3;.

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

2-[3-[3-(3-tert-butyl-5-phenylphenyl)-5-[2,6-di(propan-2-yl)phenyl]-2H-imidazol-2-id-1-yl]benzene-2-id-1-yl]oxy-4-(2-phenylpropan-2-yl)-9-[4-(2-phenylpropan-2-yl)-2-pyridinyl]-1H-carbazol-1-ide;platinum has a molecular weight of 1201.45 g/mol, XLogP of 18.88, 13 rotatable bonds, 0 hydrogen bond donors, and 5 hydrogen bond acceptors.

Where does this data come from?

All data for 2-[3-[3-(3-tert-butyl-5-phenylphenyl)-5-[2,6-di(propan-2-yl)phenyl]-2H-imidazol-2-id-1-yl]benzene-2-id-1-yl]oxy-4-(2-phenylpropan-2-yl)-9-[4-(2-phenylpropan-2-yl)-2-pyridinyl]-1H-carbazol-1-ide;platinum is sourced from PubChem (CID 162448885), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).