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

C80H79N4Pt-3 — CID 162449286

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

2-[[3-tert-butyl-5-[3-(3,5-ditert-butylphenyl)-2H-benzimidazol-2-id-1-yl]benzene-6-id-1-yl]-diphenylmethyl]-6-(4-tert-butylphenyl)-9-[4-(2-phenylpropan-2-yl)-2-pyridinyl]-1H-carbazol-1-ide;platinum (PubChem CID 162449286) has the molecular formula C80H79N4Pt-3 and a molecular weight of 1291.62 g/mol. Its IUPAC name is 2-[[3-tert-butyl-5-[3-(3,5-ditert-butylphenyl)-2H-benzimidazol-2-id-1-yl]benzene-6-id-1-yl]-diphenylmethyl]-6-(4-tert-butylphenyl)-9-[4-(2-phenylpropan-2-yl)-2-pyridinyl]-1H-carbazol-1-ide;platinum.

Molecular Properties

• Compound Name: 2-[[3-tert-butyl-5-[3-(3,5-ditert-butylphenyl)-2H-benzimidazol-2-id-1-yl]benzene-6-id-1-yl]-diphenylmethyl]-6-(4-tert-butylphenyl)-9-[4-(2-phenylpropan-2-yl)-2-pyridinyl]-1H-carbazol-1-ide;platinum
• PubChem CID: 162449286
• Molecular Formula: C80H79N4Pt-3
• Molecular Weight: 1291.62 g/mol
• Exact Mass: 1290.60
• IUPAC Name: 2-[[3-tert-butyl-5-[3-(3,5-ditert-butylphenyl)-2H-benzimidazol-2-id-1-yl]benzene-6-id-1-yl]-diphenylmethyl]-6-(4-tert-butylphenyl)-9-[4-(2-phenylpropan-2-yl)-2-pyridinyl]-1H-carbazol-1-ide;platinum
• SMILES: CC(C)(C)c1ccc(-c2ccc3c(c2)c2ccc(C(c4[c-]c(N5[CH-]N(c6cc(C(C)(C)C)cc(C(C)(C)C)c6)c6ccccc65)cc(C(C)(C)C)c4)(c4ccccc4)c4ccccc4)[c-]c2n3-c2cc(C(C)(C)c3ccccc3)ccn2)cc1.[Pt]
• InChI: InChI=1S/C80H79N4.Pt/c1-75(2,3)56-37-34-54(35-38-56)55-36-41-70-69(44-55)68-40-39-61(51-73(68)84(70)74-52-60(42-43-81-74)79(13,14)57-26-18-15-19-27-57)80(58-28-20-16-21-29-58,59-30-22-17-23-31-59)65-46-64(78(10,11)12)49-67(50-65)83-53-82(71-32-24-25-33-72(71)83)66-47-62(76(4,5)6)45-63(48-66)77(7,8)9;/h15-49,52-53H,1-14H3;/q-3
• InChIKey: GDOSVZFJKUMERV-UHFFFAOYSA-N
• XLogP: 20.75
• TPSA: 24.30 Ų
• H-Bond Acceptors: 4
• Rotatable Bonds: 10
• Heavy Atoms: 85
• Complexity: —

Lipinski Rule of Five

2 violations

Rule	Value
MW ≤ 500	1291.62
LogP ≤ 5	20.75
H-Bond Donors ≤ 5	0
H-Bond Acceptors ≤ 10	4

Computed Properties (RDKit)

• Structural Alerts: {'alert_name': 'Carbo_cation/anion', 'substructure': 'N/A'}, {'alert_name': 'triphenyl_methyl-silyl', 'substructure': 'N/A'}

Frequently Asked Questions

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

The IUPAC name of 2-[[3-tert-butyl-5-[3-(3,5-ditert-butylphenyl)-2H-benzimidazol-2-id-1-yl]benzene-6-id-1-yl]-diphenylmethyl]-6-(4-tert-butylphenyl)-9-[4-(2-phenylpropan-2-yl)-2-pyridinyl]-1H-carbazol-1-ide;platinum (CID 162449286) is 2-[[3-tert-butyl-5-[3-(3,5-ditert-butylphenyl)-2H-benzimidazol-2-id-1-yl]benzene-6-id-1-yl]-diphenylmethyl]-6-(4-tert-butylphenyl)-9-[4-(2-phenylpropan-2-yl)-2-pyridinyl]-1H-carbazol-1-ide;platinum.

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

The canonical SMILES for 2-[[3-tert-butyl-5-[3-(3,5-ditert-butylphenyl)-2H-benzimidazol-2-id-1-yl]benzene-6-id-1-yl]-diphenylmethyl]-6-(4-tert-butylphenyl)-9-[4-(2-phenylpropan-2-yl)-2-pyridinyl]-1H-carbazol-1-ide;platinum is CC(C)(C)c1ccc(-c2ccc3c(c2)c2ccc(C(c4[c-]c(N5[CH-]N(c6cc(C(C)(C)C)cc(C(C)(C)C)c6)c6ccccc65)cc(C(C)(C)C)c4)(c4ccccc4)c4ccccc4)[c-]c2n3-c2cc(C(C)(C)c3ccccc3)ccn2)cc1.[Pt].

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

The InChIKey is GDOSVZFJKUMERV-UHFFFAOYSA-N. The full InChI is InChI=1S/C80H79N4.Pt/c1-75(2,3)56-37-34-54(35-38-56)55-36-41-70-69(44-55)68-40-39-61(51-73(68)84(70)74-52-60(42-43-81-74)79(13,14)57-26-18-15-19-27-57)80(58-28-20-16-21-29-58,59-30-22-17-23-31-59)65-46-64(78(10,11)12)49-67(50-65)83-53-82(71-32-24-25-33-72(71)83)66-47-62(76(4,5)6)45-63(48-66)77(7,8)9;/h15-49,52-53H,1-14H3;/q-3;.

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

2-[[3-tert-butyl-5-[3-(3,5-ditert-butylphenyl)-2H-benzimidazol-2-id-1-yl]benzene-6-id-1-yl]-diphenylmethyl]-6-(4-tert-butylphenyl)-9-[4-(2-phenylpropan-2-yl)-2-pyridinyl]-1H-carbazol-1-ide;platinum has a molecular weight of 1291.62 g/mol, XLogP of 20.75, 10 rotatable bonds, 0 hydrogen bond donors, and 4 hydrogen bond acceptors.

Where does this data come from?

All data for 2-[[3-tert-butyl-5-[3-(3,5-ditert-butylphenyl)-2H-benzimidazol-2-id-1-yl]benzene-6-id-1-yl]-diphenylmethyl]-6-(4-tert-butylphenyl)-9-[4-(2-phenylpropan-2-yl)-2-pyridinyl]-1H-carbazol-1-ide;platinum is sourced from PubChem (CID 162449286), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).