2,4-ditert-butyl-6-[4-[3-tert-butyl-5-(4-phenyl-2-pyridinyl)benzene-6-id-1-yl]-1-[4-(1,1-difluoro-2-trimethylsilylethyl)-2-phenylphenyl]benzimidazol-2-yl]phenol;platinum

C59H62F2N3OPtSi- — CID 170533874

About 2,4-ditert-butyl-6-[4-[3-tert-butyl-5-(4-phenyl-2-pyridinyl)benzene-6-id-1-yl]-1-[4-(1,1-difluoro-2-trimethylsilylethyl)-2-phenylphenyl]benzimidazol-2-yl]phenol;platinum

2,4-ditert-butyl-6-[4-[3-tert-butyl-5-(4-phenyl-2-pyridinyl)benzene-6-id-1-yl]-1-[4-(1,1-difluoro-2-trimethylsilylethyl)-2-phenylphenyl]benzimidazol-2-yl]phenol;platinum (PubChem CID 170533874) has the molecular formula C59H62F2N3OPtSi- and a molecular weight of 1090.32 g/mol. Its IUPAC name is 2,4-ditert-butyl-6-[4-[3-tert-butyl-5-(4-phenyl-2-pyridinyl)benzene-6-id-1-yl]-1-[4-(1,1-difluoro-2-trimethylsilylethyl)-2-phenylphenyl]benzimidazol-2-yl]phenol;platinum.

Molecular Properties

• Compound Name: 2,4-ditert-butyl-6-[4-[3-tert-butyl-5-(4-phenyl-2-pyridinyl)benzene-6-id-1-yl]-1-[4-(1,1-difluoro-2-trimethylsilylethyl)-2-phenylphenyl]benzimidazol-2-yl]phenol;platinum
• PubChem CID: 170533874
• Molecular Formula: C59H62F2N3OPtSi-
• Molecular Weight: 1090.32 g/mol
• Exact Mass: 1089.43
• IUPAC Name: 2,4-ditert-butyl-6-[4-[3-tert-butyl-5-(4-phenyl-2-pyridinyl)benzene-6-id-1-yl]-1-[4-(1,1-difluoro-2-trimethylsilylethyl)-2-phenylphenyl]benzimidazol-2-yl]phenol;platinum
• SMILES: CC(C)(C)c1cc(-c2cc(-c3ccccc3)ccn2)[c-]c(-c2cccc3c2nc(-c2cc(C(C)(C)C)cc(C(C)(C)C)c2O)n3-c2ccc(C(F)(F)C[Si](C)(C)C)cc2-c2ccccc2)c1.[Pt]
• InChI: InChI=1S/C59H62F2N3OSi.Pt/c1-56(2,3)44-31-41(30-42(32-44)50-33-40(28-29-62-50)38-20-15-13-16-21-38)46-24-19-25-52-53(46)63-55(48-35-45(57(4,5)6)36-49(54(48)65)58(7,8)9)64(52)51-27-26-43(59(60,61)37-66(10,11)12)34-47(51)39-22-17-14-18-23-39;/h13-29,31-36,65H,37H2,1-12H3;/q-1
• InChIKey: GAXNHUBYUCKXOT-UHFFFAOYSA-N
• XLogP: 16.58
• TPSA: 50.94 Ų
• H-Bond Donors: 1
• H-Bond Acceptors: 4
• Rotatable Bonds: 9
• Heavy Atoms: 67
• Complexity: —

Lipinski Rule of Five

2 violations

Rule	Value
MW ≤ 500	1090.32
LogP ≤ 5	16.58
H-Bond Donors ≤ 5	1
H-Bond Acceptors ≤ 10	4

Computed Properties (RDKit)

• Structural Alerts: {'alert_name': 'Carbo_cation/anion', 'substructure': 'N/A'}, {'alert_name': 'heavy_metal', 'substructure': 'N/A'}

Frequently Asked Questions

What is the IUPAC name of 2,4-ditert-butyl-6-[4-[3-tert-butyl-5-(4-phenyl-2-pyridinyl)benzene-6-id-1-yl]-1-[4-(1,1-difluoro-2-trimethylsilylethyl)-2-phenylphenyl]benzimidazol-2-yl]phenol;platinum?

The IUPAC name of 2,4-ditert-butyl-6-[4-[3-tert-butyl-5-(4-phenyl-2-pyridinyl)benzene-6-id-1-yl]-1-[4-(1,1-difluoro-2-trimethylsilylethyl)-2-phenylphenyl]benzimidazol-2-yl]phenol;platinum (CID 170533874) is 2,4-ditert-butyl-6-[4-[3-tert-butyl-5-(4-phenyl-2-pyridinyl)benzene-6-id-1-yl]-1-[4-(1,1-difluoro-2-trimethylsilylethyl)-2-phenylphenyl]benzimidazol-2-yl]phenol;platinum.

What is the SMILES notation for 2,4-ditert-butyl-6-[4-[3-tert-butyl-5-(4-phenyl-2-pyridinyl)benzene-6-id-1-yl]-1-[4-(1,1-difluoro-2-trimethylsilylethyl)-2-phenylphenyl]benzimidazol-2-yl]phenol;platinum?

The canonical SMILES for 2,4-ditert-butyl-6-[4-[3-tert-butyl-5-(4-phenyl-2-pyridinyl)benzene-6-id-1-yl]-1-[4-(1,1-difluoro-2-trimethylsilylethyl)-2-phenylphenyl]benzimidazol-2-yl]phenol;platinum is CC(C)(C)c1cc(-c2cc(-c3ccccc3)ccn2)[c-]c(-c2cccc3c2nc(-c2cc(C(C)(C)C)cc(C(C)(C)C)c2O)n3-c2ccc(C(F)(F)C[Si](C)(C)C)cc2-c2ccccc2)c1.[Pt].

What is the InChIKey of 2,4-ditert-butyl-6-[4-[3-tert-butyl-5-(4-phenyl-2-pyridinyl)benzene-6-id-1-yl]-1-[4-(1,1-difluoro-2-trimethylsilylethyl)-2-phenylphenyl]benzimidazol-2-yl]phenol;platinum?

The InChIKey is GAXNHUBYUCKXOT-UHFFFAOYSA-N. The full InChI is InChI=1S/C59H62F2N3OSi.Pt/c1-56(2,3)44-31-41(30-42(32-44)50-33-40(28-29-62-50)38-20-15-13-16-21-38)46-24-19-25-52-53(46)63-55(48-35-45(57(4,5)6)36-49(54(48)65)58(7,8)9)64(52)51-27-26-43(59(60,61)37-66(10,11)12)34-47(51)39-22-17-14-18-23-39;/h13-29,31-36,65H,37H2,1-12H3;/q-1;.

What are the key properties of 2,4-ditert-butyl-6-[4-[3-tert-butyl-5-(4-phenyl-2-pyridinyl)benzene-6-id-1-yl]-1-[4-(1,1-difluoro-2-trimethylsilylethyl)-2-phenylphenyl]benzimidazol-2-yl]phenol;platinum?

2,4-ditert-butyl-6-[4-[3-tert-butyl-5-(4-phenyl-2-pyridinyl)benzene-6-id-1-yl]-1-[4-(1,1-difluoro-2-trimethylsilylethyl)-2-phenylphenyl]benzimidazol-2-yl]phenol;platinum has a molecular weight of 1090.32 g/mol, XLogP of 16.58, 9 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.

Where does this data come from?

All data for 2,4-ditert-butyl-6-[4-[3-tert-butyl-5-(4-phenyl-2-pyridinyl)benzene-6-id-1-yl]-1-[4-(1,1-difluoro-2-trimethylsilylethyl)-2-phenylphenyl]benzimidazol-2-yl]phenol;platinum is sourced from PubChem (CID 170533874), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).