2-[3-[3-(3-tert-butyl-5-phenylphenyl)-5-(3-methylpentan-3-yl)-2H-benzimidazol-2-id-1-yl]-5-(2-propan-2-ylphenyl)benzene-2-id-1-yl]oxy-9-(4-tert-butyl-2-pyridinyl)-1H-carbazol-1-ide;platinum

C65H65N4OPt-3 — CID 155651032

About 2-[3-[3-(3-tert-butyl-5-phenylphenyl)-5-(3-methylpentan-3-yl)-2H-benzimidazol-2-id-1-yl]-5-(2-propan-2-ylphenyl)benzene-2-id-1-yl]oxy-9-(4-tert-butyl-2-pyridinyl)-1H-carbazol-1-ide;platinum

2-[3-[3-(3-tert-butyl-5-phenylphenyl)-5-(3-methylpentan-3-yl)-2H-benzimidazol-2-id-1-yl]-5-(2-propan-2-ylphenyl)benzene-2-id-1-yl]oxy-9-(4-tert-butyl-2-pyridinyl)-1H-carbazol-1-ide;platinum (PubChem CID 155651032) has the molecular formula C65H65N4OPt-3 and a molecular weight of 1113.34 g/mol. Its IUPAC name is 2-[3-[3-(3-tert-butyl-5-phenylphenyl)-5-(3-methylpentan-3-yl)-2H-benzimidazol-2-id-1-yl]-5-(2-propan-2-ylphenyl)benzene-2-id-1-yl]oxy-9-(4-tert-butyl-2-pyridinyl)-1H-carbazol-1-ide;platinum.

Molecular Properties

• Compound Name: 2-[3-[3-(3-tert-butyl-5-phenylphenyl)-5-(3-methylpentan-3-yl)-2H-benzimidazol-2-id-1-yl]-5-(2-propan-2-ylphenyl)benzene-2-id-1-yl]oxy-9-(4-tert-butyl-2-pyridinyl)-1H-carbazol-1-ide;platinum
• PubChem CID: 155651032
• Molecular Formula: C65H65N4OPt-3
• Molecular Weight: 1113.34 g/mol
• Exact Mass: 1112.48
• IUPAC Name: 2-[3-[3-(3-tert-butyl-5-phenylphenyl)-5-(3-methylpentan-3-yl)-2H-benzimidazol-2-id-1-yl]-5-(2-propan-2-ylphenyl)benzene-2-id-1-yl]oxy-9-(4-tert-butyl-2-pyridinyl)-1H-carbazol-1-ide;platinum
• SMILES: CCC(C)(CC)c1ccc2c(c1)N(c1cc(-c3ccccc3)cc(C(C)(C)C)c1)[CH-]N2c1[c-]c(Oc2[c-]c3c(cc2)c2ccccc2n3-c2cc(C(C)(C)C)ccn2)cc(-c2ccccc2C(C)C)c1.[Pt]
• InChI: InChI=1S/C65H65N4O.Pt/c1-12-65(11,13-2)48-27-30-59-61(38-48)68(50-34-45(44-21-15-14-16-22-44)33-49(37-50)64(8,9)10)42-67(59)51-35-46(55-24-18-17-23-54(55)43(3)4)36-53(40-51)70-52-28-29-57-56-25-19-20-26-58(56)69(60(57)41-52)62-39-47(31-32-66-62)63(5,6)7;/h14-39,42-43H,12-13H2,1-11H3;/q-3
• InChIKey: XKQWTQNVPOWRNF-UHFFFAOYSA-N
• XLogP: 18.11
• TPSA: 33.53 Ų
• H-Bond Acceptors: 5
• Rotatable Bonds: 11
• Heavy Atoms: 71
• Complexity: —

Lipinski Rule of Five

2 violations

Rule	Value
MW ≤ 500	1113.34
LogP ≤ 5	18.11
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-(3-methylpentan-3-yl)-2H-benzimidazol-2-id-1-yl]-5-(2-propan-2-ylphenyl)benzene-2-id-1-yl]oxy-9-(4-tert-butyl-2-pyridinyl)-1H-carbazol-1-ide;platinum?

The IUPAC name of 2-[3-[3-(3-tert-butyl-5-phenylphenyl)-5-(3-methylpentan-3-yl)-2H-benzimidazol-2-id-1-yl]-5-(2-propan-2-ylphenyl)benzene-2-id-1-yl]oxy-9-(4-tert-butyl-2-pyridinyl)-1H-carbazol-1-ide;platinum (CID 155651032) is 2-[3-[3-(3-tert-butyl-5-phenylphenyl)-5-(3-methylpentan-3-yl)-2H-benzimidazol-2-id-1-yl]-5-(2-propan-2-ylphenyl)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-[3-(3-tert-butyl-5-phenylphenyl)-5-(3-methylpentan-3-yl)-2H-benzimidazol-2-id-1-yl]-5-(2-propan-2-ylphenyl)benzene-2-id-1-yl]oxy-9-(4-tert-butyl-2-pyridinyl)-1H-carbazol-1-ide;platinum?

The canonical SMILES for 2-[3-[3-(3-tert-butyl-5-phenylphenyl)-5-(3-methylpentan-3-yl)-2H-benzimidazol-2-id-1-yl]-5-(2-propan-2-ylphenyl)benzene-2-id-1-yl]oxy-9-(4-tert-butyl-2-pyridinyl)-1H-carbazol-1-ide;platinum is CCC(C)(CC)c1ccc2c(c1)N(c1cc(-c3ccccc3)cc(C(C)(C)C)c1)[CH-]N2c1[c-]c(Oc2[c-]c3c(cc2)c2ccccc2n3-c2cc(C(C)(C)C)ccn2)cc(-c2ccccc2C(C)C)c1.[Pt].

What is the InChIKey of 2-[3-[3-(3-tert-butyl-5-phenylphenyl)-5-(3-methylpentan-3-yl)-2H-benzimidazol-2-id-1-yl]-5-(2-propan-2-ylphenyl)benzene-2-id-1-yl]oxy-9-(4-tert-butyl-2-pyridinyl)-1H-carbazol-1-ide;platinum?

The InChIKey is XKQWTQNVPOWRNF-UHFFFAOYSA-N. The full InChI is InChI=1S/C65H65N4O.Pt/c1-12-65(11,13-2)48-27-30-59-61(38-48)68(50-34-45(44-21-15-14-16-22-44)33-49(37-50)64(8,9)10)42-67(59)51-35-46(55-24-18-17-23-54(55)43(3)4)36-53(40-51)70-52-28-29-57-56-25-19-20-26-58(56)69(60(57)41-52)62-39-47(31-32-66-62)63(5,6)7;/h14-39,42-43H,12-13H2,1-11H3;/q-3;.

What are the key properties of 2-[3-[3-(3-tert-butyl-5-phenylphenyl)-5-(3-methylpentan-3-yl)-2H-benzimidazol-2-id-1-yl]-5-(2-propan-2-ylphenyl)benzene-2-id-1-yl]oxy-9-(4-tert-butyl-2-pyridinyl)-1H-carbazol-1-ide;platinum?

2-[3-[3-(3-tert-butyl-5-phenylphenyl)-5-(3-methylpentan-3-yl)-2H-benzimidazol-2-id-1-yl]-5-(2-propan-2-ylphenyl)benzene-2-id-1-yl]oxy-9-(4-tert-butyl-2-pyridinyl)-1H-carbazol-1-ide;platinum has a molecular weight of 1113.34 g/mol, XLogP of 18.11, 11 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-(3-methylpentan-3-yl)-2H-benzimidazol-2-id-1-yl]-5-(2-propan-2-ylphenyl)benzene-2-id-1-yl]oxy-9-(4-tert-butyl-2-pyridinyl)-1H-carbazol-1-ide;platinum is sourced from PubChem (CID 155651032), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).