9-(4-tert-butyl-2-pyridinyl)-2-[3-[3-[2,6-ditert-butyl-4-(4-tert-butyl-2,6-dimethylphenyl)phenyl]-2H-benzimidazol-2-id-1-yl]benzene-2-id-1-yl]oxy-1H-carbazol-1-ide;platinum

C60H63N4OPt-3 — CID 176783738

About 9-(4-tert-butyl-2-pyridinyl)-2-[3-[3-[2,6-ditert-butyl-4-(4-tert-butyl-2,6-dimethylphenyl)phenyl]-2H-benzimidazol-2-id-1-yl]benzene-2-id-1-yl]oxy-1H-carbazol-1-ide;platinum

9-(4-tert-butyl-2-pyridinyl)-2-[3-[3-[2,6-ditert-butyl-4-(4-tert-butyl-2,6-dimethylphenyl)phenyl]-2H-benzimidazol-2-id-1-yl]benzene-2-id-1-yl]oxy-1H-carbazol-1-ide;platinum (PubChem CID 176783738) has the molecular formula C60H63N4OPt-3 and a molecular weight of 1051.27 g/mol. Its IUPAC name is 9-(4-tert-butyl-2-pyridinyl)-2-[3-[3-[2,6-ditert-butyl-4-(4-tert-butyl-2,6-dimethylphenyl)phenyl]-2H-benzimidazol-2-id-1-yl]benzene-2-id-1-yl]oxy-1H-carbazol-1-ide;platinum.

Molecular Properties

• Compound Name: 9-(4-tert-butyl-2-pyridinyl)-2-[3-[3-[2,6-ditert-butyl-4-(4-tert-butyl-2,6-dimethylphenyl)phenyl]-2H-benzimidazol-2-id-1-yl]benzene-2-id-1-yl]oxy-1H-carbazol-1-ide;platinum
• PubChem CID: 176783738
• Molecular Formula: C60H63N4OPt-3
• Molecular Weight: 1051.27 g/mol
• Exact Mass: 1050.47
• IUPAC Name: 9-(4-tert-butyl-2-pyridinyl)-2-[3-[3-[2,6-ditert-butyl-4-(4-tert-butyl-2,6-dimethylphenyl)phenyl]-2H-benzimidazol-2-id-1-yl]benzene-2-id-1-yl]oxy-1H-carbazol-1-ide;platinum
• SMILES: Cc1cc(C(C)(C)C)cc(C)c1-c1cc(C(C)(C)C)c(N2[CH-]N(c3[c-]c(Oc4[c-]c5c(cc4)c4ccccc4n5-c4cc(C(C)(C)C)ccn4)ccc3)c3ccccc32)c(C(C)(C)C)c1.[Pt]
• InChI: InChI=1S/C60H63N4O.Pt/c1-38-30-42(58(6,7)8)31-39(2)55(38)40-32-48(59(9,10)11)56(49(33-40)60(12,13)14)63-37-62(51-24-17-18-25-52(51)63)43-20-19-21-44(35-43)65-45-26-27-47-46-22-15-16-23-50(46)64(53(47)36-45)54-34-41(28-29-61-54)57(3,4)5;/h15-34,37H,1-14H3;/q-3
• InChIKey: DJYYMAGVQSDMRS-UHFFFAOYSA-N
• XLogP: 16.45
• TPSA: 33.53 Ų
• H-Bond Acceptors: 5
• Rotatable Bonds: 6
• Heavy Atoms: 66
• Complexity: —

Lipinski Rule of Five

2 violations

Rule	Value
MW ≤ 500	1051.27
LogP ≤ 5	16.45
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 9-(4-tert-butyl-2-pyridinyl)-2-[3-[3-[2,6-ditert-butyl-4-(4-tert-butyl-2,6-dimethylphenyl)phenyl]-2H-benzimidazol-2-id-1-yl]benzene-2-id-1-yl]oxy-1H-carbazol-1-ide;platinum?

The IUPAC name of 9-(4-tert-butyl-2-pyridinyl)-2-[3-[3-[2,6-ditert-butyl-4-(4-tert-butyl-2,6-dimethylphenyl)phenyl]-2H-benzimidazol-2-id-1-yl]benzene-2-id-1-yl]oxy-1H-carbazol-1-ide;platinum (CID 176783738) is 9-(4-tert-butyl-2-pyridinyl)-2-[3-[3-[2,6-ditert-butyl-4-(4-tert-butyl-2,6-dimethylphenyl)phenyl]-2H-benzimidazol-2-id-1-yl]benzene-2-id-1-yl]oxy-1H-carbazol-1-ide;platinum.

What is the SMILES notation for 9-(4-tert-butyl-2-pyridinyl)-2-[3-[3-[2,6-ditert-butyl-4-(4-tert-butyl-2,6-dimethylphenyl)phenyl]-2H-benzimidazol-2-id-1-yl]benzene-2-id-1-yl]oxy-1H-carbazol-1-ide;platinum?

The canonical SMILES for 9-(4-tert-butyl-2-pyridinyl)-2-[3-[3-[2,6-ditert-butyl-4-(4-tert-butyl-2,6-dimethylphenyl)phenyl]-2H-benzimidazol-2-id-1-yl]benzene-2-id-1-yl]oxy-1H-carbazol-1-ide;platinum is Cc1cc(C(C)(C)C)cc(C)c1-c1cc(C(C)(C)C)c(N2[CH-]N(c3[c-]c(Oc4[c-]c5c(cc4)c4ccccc4n5-c4cc(C(C)(C)C)ccn4)ccc3)c3ccccc32)c(C(C)(C)C)c1.[Pt].

What is the InChIKey of 9-(4-tert-butyl-2-pyridinyl)-2-[3-[3-[2,6-ditert-butyl-4-(4-tert-butyl-2,6-dimethylphenyl)phenyl]-2H-benzimidazol-2-id-1-yl]benzene-2-id-1-yl]oxy-1H-carbazol-1-ide;platinum?

The InChIKey is DJYYMAGVQSDMRS-UHFFFAOYSA-N. The full InChI is InChI=1S/C60H63N4O.Pt/c1-38-30-42(58(6,7)8)31-39(2)55(38)40-32-48(59(9,10)11)56(49(33-40)60(12,13)14)63-37-62(51-24-17-18-25-52(51)63)43-20-19-21-44(35-43)65-45-26-27-47-46-22-15-16-23-50(46)64(53(47)36-45)54-34-41(28-29-61-54)57(3,4)5;/h15-34,37H,1-14H3;/q-3;.

What are the key properties of 9-(4-tert-butyl-2-pyridinyl)-2-[3-[3-[2,6-ditert-butyl-4-(4-tert-butyl-2,6-dimethylphenyl)phenyl]-2H-benzimidazol-2-id-1-yl]benzene-2-id-1-yl]oxy-1H-carbazol-1-ide;platinum?

9-(4-tert-butyl-2-pyridinyl)-2-[3-[3-[2,6-ditert-butyl-4-(4-tert-butyl-2,6-dimethylphenyl)phenyl]-2H-benzimidazol-2-id-1-yl]benzene-2-id-1-yl]oxy-1H-carbazol-1-ide;platinum has a molecular weight of 1051.27 g/mol, XLogP of 16.45, 6 rotatable bonds, 0 hydrogen bond donors, and 5 hydrogen bond acceptors.

Where does this data come from?

All data for 9-(4-tert-butyl-2-pyridinyl)-2-[3-[3-[2,6-ditert-butyl-4-(4-tert-butyl-2,6-dimethylphenyl)phenyl]-2H-benzimidazol-2-id-1-yl]benzene-2-id-1-yl]oxy-1H-carbazol-1-ide;platinum is sourced from PubChem (CID 176783738), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).