9-(4-tert-butyl-2-pyridinyl)-2-[[3-[3-[4-[2-(3,5-ditert-butylphenyl)-6-(2-methylpropyl)phenyl]butyl]-2H-benzimidazol-2-id-1-yl]benzene-2-id-1-yl]methoxy]-1H-carbazol-1-ide;platinum

C63H69N4OPt-3 — CID 168751362

About 9-(4-tert-butyl-2-pyridinyl)-2-[[3-[3-[4-[2-(3,5-ditert-butylphenyl)-6-(2-methylpropyl)phenyl]butyl]-2H-benzimidazol-2-id-1-yl]benzene-2-id-1-yl]methoxy]-1H-carbazol-1-ide;platinum

9-(4-tert-butyl-2-pyridinyl)-2-[[3-[3-[4-[2-(3,5-ditert-butylphenyl)-6-(2-methylpropyl)phenyl]butyl]-2H-benzimidazol-2-id-1-yl]benzene-2-id-1-yl]methoxy]-1H-carbazol-1-ide;platinum (PubChem CID 168751362) has the molecular formula C63H69N4OPt-3 and a molecular weight of 1093.35 g/mol. Its IUPAC name is 9-(4-tert-butyl-2-pyridinyl)-2-[[3-[3-[4-[2-(3,5-ditert-butylphenyl)-6-(2-methylpropyl)phenyl]butyl]-2H-benzimidazol-2-id-1-yl]benzene-2-id-1-yl]methoxy]-1H-carbazol-1-ide;platinum.

Molecular Properties

• Compound Name: 9-(4-tert-butyl-2-pyridinyl)-2-[[3-[3-[4-[2-(3,5-ditert-butylphenyl)-6-(2-methylpropyl)phenyl]butyl]-2H-benzimidazol-2-id-1-yl]benzene-2-id-1-yl]methoxy]-1H-carbazol-1-ide;platinum
• PubChem CID: 168751362
• Molecular Formula: C63H69N4OPt-3
• Molecular Weight: 1093.35 g/mol
• Exact Mass: 1092.51
• IUPAC Name: 9-(4-tert-butyl-2-pyridinyl)-2-[[3-[3-[4-[2-(3,5-ditert-butylphenyl)-6-(2-methylpropyl)phenyl]butyl]-2H-benzimidazol-2-id-1-yl]benzene-2-id-1-yl]methoxy]-1H-carbazol-1-ide;platinum
• SMILES: CC(C)Cc1cccc(-c2cc(C(C)(C)C)cc(C(C)(C)C)c2)c1CCCCN1[CH-]N(c2[c-]c(COc3[c-]c4c(cc3)c3ccccc3n4-c3cc(C(C)(C)C)ccn3)ccc2)c2ccccc21.[Pt]
• InChI: InChI=1S/C63H69N4O.Pt/c1-43(2)34-45-21-19-25-53(46-36-48(62(6,7)8)38-49(37-46)63(9,10)11)52(45)23-16-17-33-65-42-66(58-28-15-14-27-57(58)65)50-22-18-20-44(35-50)41-68-51-29-30-55-54-24-12-13-26-56(54)67(59(55)40-51)60-39-47(31-32-64-60)61(3,4)5;/h12-15,18-22,24-32,36-39,42-43H,16-17,23,33-34,41H2,1-11H3;/q-3
• InChIKey: HETMVVLPPQXVQM-UHFFFAOYSA-N
• XLogP: 16.21
• TPSA: 33.53 Ų
• H-Bond Acceptors: 5
• Rotatable Bonds: 13
• Heavy Atoms: 69
• Complexity: —

Lipinski Rule of Five

2 violations

Rule	Value
MW ≤ 500	1093.35
LogP ≤ 5	16.21
H-Bond Donors ≤ 5	0
H-Bond Acceptors ≤ 10	5

Computed Properties (RDKit)

• Structural Alerts: {'alert_name': 'Aliphatic_long_chain', 'substructure': 'N/A'}, {'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-[4-[2-(3,5-ditert-butylphenyl)-6-(2-methylpropyl)phenyl]butyl]-2H-benzimidazol-2-id-1-yl]benzene-2-id-1-yl]methoxy]-1H-carbazol-1-ide;platinum?

The IUPAC name of 9-(4-tert-butyl-2-pyridinyl)-2-[[3-[3-[4-[2-(3,5-ditert-butylphenyl)-6-(2-methylpropyl)phenyl]butyl]-2H-benzimidazol-2-id-1-yl]benzene-2-id-1-yl]methoxy]-1H-carbazol-1-ide;platinum (CID 168751362) is 9-(4-tert-butyl-2-pyridinyl)-2-[[3-[3-[4-[2-(3,5-ditert-butylphenyl)-6-(2-methylpropyl)phenyl]butyl]-2H-benzimidazol-2-id-1-yl]benzene-2-id-1-yl]methoxy]-1H-carbazol-1-ide;platinum.

What is the SMILES notation for 9-(4-tert-butyl-2-pyridinyl)-2-[[3-[3-[4-[2-(3,5-ditert-butylphenyl)-6-(2-methylpropyl)phenyl]butyl]-2H-benzimidazol-2-id-1-yl]benzene-2-id-1-yl]methoxy]-1H-carbazol-1-ide;platinum?

The canonical SMILES for 9-(4-tert-butyl-2-pyridinyl)-2-[[3-[3-[4-[2-(3,5-ditert-butylphenyl)-6-(2-methylpropyl)phenyl]butyl]-2H-benzimidazol-2-id-1-yl]benzene-2-id-1-yl]methoxy]-1H-carbazol-1-ide;platinum is CC(C)Cc1cccc(-c2cc(C(C)(C)C)cc(C(C)(C)C)c2)c1CCCCN1[CH-]N(c2[c-]c(COc3[c-]c4c(cc3)c3ccccc3n4-c3cc(C(C)(C)C)ccn3)ccc2)c2ccccc21.[Pt].

What is the InChIKey of 9-(4-tert-butyl-2-pyridinyl)-2-[[3-[3-[4-[2-(3,5-ditert-butylphenyl)-6-(2-methylpropyl)phenyl]butyl]-2H-benzimidazol-2-id-1-yl]benzene-2-id-1-yl]methoxy]-1H-carbazol-1-ide;platinum?

The InChIKey is HETMVVLPPQXVQM-UHFFFAOYSA-N. The full InChI is InChI=1S/C63H69N4O.Pt/c1-43(2)34-45-21-19-25-53(46-36-48(62(6,7)8)38-49(37-46)63(9,10)11)52(45)23-16-17-33-65-42-66(58-28-15-14-27-57(58)65)50-22-18-20-44(35-50)41-68-51-29-30-55-54-24-12-13-26-56(54)67(59(55)40-51)60-39-47(31-32-64-60)61(3,4)5;/h12-15,18-22,24-32,36-39,42-43H,16-17,23,33-34,41H2,1-11H3;/q-3;.

What are the key properties of 9-(4-tert-butyl-2-pyridinyl)-2-[[3-[3-[4-[2-(3,5-ditert-butylphenyl)-6-(2-methylpropyl)phenyl]butyl]-2H-benzimidazol-2-id-1-yl]benzene-2-id-1-yl]methoxy]-1H-carbazol-1-ide;platinum?

9-(4-tert-butyl-2-pyridinyl)-2-[[3-[3-[4-[2-(3,5-ditert-butylphenyl)-6-(2-methylpropyl)phenyl]butyl]-2H-benzimidazol-2-id-1-yl]benzene-2-id-1-yl]methoxy]-1H-carbazol-1-ide;platinum has a molecular weight of 1093.35 g/mol, XLogP of 16.21, 13 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-[4-[2-(3,5-ditert-butylphenyl)-6-(2-methylpropyl)phenyl]butyl]-2H-benzimidazol-2-id-1-yl]benzene-2-id-1-yl]methoxy]-1H-carbazol-1-ide;platinum is sourced from PubChem (CID 168751362), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).