2-[3-[5-tert-butyl-3-[3-[5-tert-butyl-2-[3-(3,5-ditert-butylphenyl)phenyl]phenyl]propyl]-2H-benzimidazol-2-id-1-yl]benzene-2-id-1-yl]oxy-9-(4-tert-butyl-2-pyridinyl)-1H-carbazol-1-ide;platinum

C71H77N4OPt-3 — CID 168751569

About 2-[3-[5-tert-butyl-3-[3-[5-tert-butyl-2-[3-(3,5-ditert-butylphenyl)phenyl]phenyl]propyl]-2H-benzimidazol-2-id-1-yl]benzene-2-id-1-yl]oxy-9-(4-tert-butyl-2-pyridinyl)-1H-carbazol-1-ide;platinum

2-[3-[5-tert-butyl-3-[3-[5-tert-butyl-2-[3-(3,5-ditert-butylphenyl)phenyl]phenyl]propyl]-2H-benzimidazol-2-id-1-yl]benzene-2-id-1-yl]oxy-9-(4-tert-butyl-2-pyridinyl)-1H-carbazol-1-ide;platinum (PubChem CID 168751569) has the molecular formula C71H77N4OPt-3 and a molecular weight of 1197.50 g/mol. Its IUPAC name is 2-[3-[5-tert-butyl-3-[3-[5-tert-butyl-2-[3-(3,5-ditert-butylphenyl)phenyl]phenyl]propyl]-2H-benzimidazol-2-id-1-yl]benzene-2-id-1-yl]oxy-9-(4-tert-butyl-2-pyridinyl)-1H-carbazol-1-ide;platinum.

Molecular Properties

• Compound Name: 2-[3-[5-tert-butyl-3-[3-[5-tert-butyl-2-[3-(3,5-ditert-butylphenyl)phenyl]phenyl]propyl]-2H-benzimidazol-2-id-1-yl]benzene-2-id-1-yl]oxy-9-(4-tert-butyl-2-pyridinyl)-1H-carbazol-1-ide;platinum
• PubChem CID: 168751569
• Molecular Formula: C71H77N4OPt-3
• Molecular Weight: 1197.50 g/mol
• Exact Mass: 1196.58
• IUPAC Name: 2-[3-[5-tert-butyl-3-[3-[5-tert-butyl-2-[3-(3,5-ditert-butylphenyl)phenyl]phenyl]propyl]-2H-benzimidazol-2-id-1-yl]benzene-2-id-1-yl]oxy-9-(4-tert-butyl-2-pyridinyl)-1H-carbazol-1-ide;platinum
• SMILES: CC(C)(C)c1cc(-c2cccc(-c3ccc(C(C)(C)C)cc3CCCN3[CH-]N(c4[c-]c(Oc5[c-]c6c(cc5)c5ccccc5n6-c5cc(C(C)(C)C)ccn5)ccc4)c4ccc(C(C)(C)C)cc43)c2)cc(C(C)(C)C)c1.[Pt]
• InChI: InChI=1S/C71H77N4O.Pt/c1-67(2,3)51-28-31-59(48-22-18-21-47(37-48)50-39-54(70(10,11)12)41-55(40-50)71(13,14)15)49(38-51)23-20-36-73-46-74(63-33-29-52(42-65(63)73)68(4,5)6)56-24-19-25-57(44-56)76-58-30-32-61-60-26-16-17-27-62(60)75(64(61)45-58)66-43-53(34-35-72-66)69(7,8)9;/h16-19,21-22,24-35,37-43,46H,20,23,36H2,1-15H3;/q-3
• InChIKey: IUNXRUAOOHIYJV-UHFFFAOYSA-N
• XLogP: 19.10
• TPSA: 33.53 Ų
• H-Bond Acceptors: 5
• Rotatable Bonds: 10
• Heavy Atoms: 77
• Complexity: —

Lipinski Rule of Five

2 violations

Rule	Value
MW ≤ 500	1197.50
LogP ≤ 5	19.10
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-[5-tert-butyl-3-[3-[5-tert-butyl-2-[3-(3,5-ditert-butylphenyl)phenyl]phenyl]propyl]-2H-benzimidazol-2-id-1-yl]benzene-2-id-1-yl]oxy-9-(4-tert-butyl-2-pyridinyl)-1H-carbazol-1-ide;platinum?

The IUPAC name of 2-[3-[5-tert-butyl-3-[3-[5-tert-butyl-2-[3-(3,5-ditert-butylphenyl)phenyl]phenyl]propyl]-2H-benzimidazol-2-id-1-yl]benzene-2-id-1-yl]oxy-9-(4-tert-butyl-2-pyridinyl)-1H-carbazol-1-ide;platinum (CID 168751569) is 2-[3-[5-tert-butyl-3-[3-[5-tert-butyl-2-[3-(3,5-ditert-butylphenyl)phenyl]phenyl]propyl]-2H-benzimidazol-2-id-1-yl]benzene-2-id-1-yl]oxy-9-(4-tert-butyl-2-pyridinyl)-1H-carbazol-1-ide;platinum.

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

The canonical SMILES for 2-[3-[5-tert-butyl-3-[3-[5-tert-butyl-2-[3-(3,5-ditert-butylphenyl)phenyl]phenyl]propyl]-2H-benzimidazol-2-id-1-yl]benzene-2-id-1-yl]oxy-9-(4-tert-butyl-2-pyridinyl)-1H-carbazol-1-ide;platinum is CC(C)(C)c1cc(-c2cccc(-c3ccc(C(C)(C)C)cc3CCCN3[CH-]N(c4[c-]c(Oc5[c-]c6c(cc5)c5ccccc5n6-c5cc(C(C)(C)C)ccn5)ccc4)c4ccc(C(C)(C)C)cc43)c2)cc(C(C)(C)C)c1.[Pt].

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

The InChIKey is IUNXRUAOOHIYJV-UHFFFAOYSA-N. The full InChI is InChI=1S/C71H77N4O.Pt/c1-67(2,3)51-28-31-59(48-22-18-21-47(37-48)50-39-54(70(10,11)12)41-55(40-50)71(13,14)15)49(38-51)23-20-36-73-46-74(63-33-29-52(42-65(63)73)68(4,5)6)56-24-19-25-57(44-56)76-58-30-32-61-60-26-16-17-27-62(60)75(64(61)45-58)66-43-53(34-35-72-66)69(7,8)9;/h16-19,21-22,24-35,37-43,46H,20,23,36H2,1-15H3;/q-3;.

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

2-[3-[5-tert-butyl-3-[3-[5-tert-butyl-2-[3-(3,5-ditert-butylphenyl)phenyl]phenyl]propyl]-2H-benzimidazol-2-id-1-yl]benzene-2-id-1-yl]oxy-9-(4-tert-butyl-2-pyridinyl)-1H-carbazol-1-ide;platinum has a molecular weight of 1197.50 g/mol, XLogP of 19.10, 10 rotatable bonds, 0 hydrogen bond donors, and 5 hydrogen bond acceptors.

Where does this data come from?

All data for 2-[3-[5-tert-butyl-3-[3-[5-tert-butyl-2-[3-(3,5-ditert-butylphenyl)phenyl]phenyl]propyl]-2H-benzimidazol-2-id-1-yl]benzene-2-id-1-yl]oxy-9-(4-tert-butyl-2-pyridinyl)-1H-carbazol-1-ide;platinum is sourced from PubChem (CID 168751569), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).