2,4-ditert-butyl-6-[4-[3-tert-butyl-5-(4-phenyl-2-pyridinyl)benzene-6-id-1-yl]-1-[(2,6-diphenylphenyl)methyl]imidazo[4,5-c]pyridin-2-yl]phenol;platinum

C60H57N4OPt- — CID 167332891

About 2,4-ditert-butyl-6-[4-[3-tert-butyl-5-(4-phenyl-2-pyridinyl)benzene-6-id-1-yl]-1-[(2,6-diphenylphenyl)methyl]imidazo[4,5-c]pyridin-2-yl]phenol;platinum

2,4-ditert-butyl-6-[4-[3-tert-butyl-5-(4-phenyl-2-pyridinyl)benzene-6-id-1-yl]-1-[(2,6-diphenylphenyl)methyl]imidazo[4,5-c]pyridin-2-yl]phenol;platinum (PubChem CID 167332891) has the molecular formula C60H57N4OPt- and a molecular weight of 1045.22 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-[(2,6-diphenylphenyl)methyl]imidazo[4,5-c]pyridin-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-[(2,6-diphenylphenyl)methyl]imidazo[4,5-c]pyridin-2-yl]phenol;platinum
• PubChem CID: 167332891
• Molecular Formula: C60H57N4OPt-
• Molecular Weight: 1045.22 g/mol
• Exact Mass: 1044.42
• IUPAC Name: 2,4-ditert-butyl-6-[4-[3-tert-butyl-5-(4-phenyl-2-pyridinyl)benzene-6-id-1-yl]-1-[(2,6-diphenylphenyl)methyl]imidazo[4,5-c]pyridin-2-yl]phenol;platinum
• SMILES: CC(C)(C)c1cc(-c2cc(-c3ccccc3)ccn2)[c-]c(-c2nccc3c2nc(-c2cc(C(C)(C)C)cc(C(C)(C)C)c2O)n3Cc2c(-c3ccccc3)cccc2-c2ccccc2)c1.[Pt]
• InChI: InChI=1S/C60H57N4O.Pt/c1-58(2,3)45-33-43(52-35-42(28-30-61-52)39-20-13-10-14-21-39)32-44(34-45)54-55-53(29-31-62-54)64(57(63-55)49-36-46(59(4,5)6)37-51(56(49)65)60(7,8)9)38-50-47(40-22-15-11-16-23-40)26-19-27-48(50)41-24-17-12-18-25-41;/h10-31,33-37,65H,38H2,1-9H3;/q-1
• InChIKey: LSUKGPMFCIRPOV-UHFFFAOYSA-N
• XLogP: 15.27
• TPSA: 63.83 Ų
• H-Bond Donors: 1
• H-Bond Acceptors: 5
• Rotatable Bonds: 8
• Heavy Atoms: 66
• Complexity: —

Lipinski Rule of Five

2 violations

Rule	Value
MW ≤ 500	1045.22
LogP ≤ 5	15.27
H-Bond Donors ≤ 5	1
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 2,4-ditert-butyl-6-[4-[3-tert-butyl-5-(4-phenyl-2-pyridinyl)benzene-6-id-1-yl]-1-[(2,6-diphenylphenyl)methyl]imidazo[4,5-c]pyridin-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-[(2,6-diphenylphenyl)methyl]imidazo[4,5-c]pyridin-2-yl]phenol;platinum (CID 167332891) is 2,4-ditert-butyl-6-[4-[3-tert-butyl-5-(4-phenyl-2-pyridinyl)benzene-6-id-1-yl]-1-[(2,6-diphenylphenyl)methyl]imidazo[4,5-c]pyridin-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-[(2,6-diphenylphenyl)methyl]imidazo[4,5-c]pyridin-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-[(2,6-diphenylphenyl)methyl]imidazo[4,5-c]pyridin-2-yl]phenol;platinum is CC(C)(C)c1cc(-c2cc(-c3ccccc3)ccn2)[c-]c(-c2nccc3c2nc(-c2cc(C(C)(C)C)cc(C(C)(C)C)c2O)n3Cc2c(-c3ccccc3)cccc2-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-[(2,6-diphenylphenyl)methyl]imidazo[4,5-c]pyridin-2-yl]phenol;platinum?

The InChIKey is LSUKGPMFCIRPOV-UHFFFAOYSA-N. The full InChI is InChI=1S/C60H57N4O.Pt/c1-58(2,3)45-33-43(52-35-42(28-30-61-52)39-20-13-10-14-21-39)32-44(34-45)54-55-53(29-31-62-54)64(57(63-55)49-36-46(59(4,5)6)37-51(56(49)65)60(7,8)9)38-50-47(40-22-15-11-16-23-40)26-19-27-48(50)41-24-17-12-18-25-41;/h10-31,33-37,65H,38H2,1-9H3;/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-[(2,6-diphenylphenyl)methyl]imidazo[4,5-c]pyridin-2-yl]phenol;platinum?

2,4-ditert-butyl-6-[4-[3-tert-butyl-5-(4-phenyl-2-pyridinyl)benzene-6-id-1-yl]-1-[(2,6-diphenylphenyl)methyl]imidazo[4,5-c]pyridin-2-yl]phenol;platinum has a molecular weight of 1045.22 g/mol, XLogP of 15.27, 8 rotatable bonds, 1 hydrogen bond donors, and 5 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-[(2,6-diphenylphenyl)methyl]imidazo[4,5-c]pyridin-2-yl]phenol;platinum is sourced from PubChem (CID 167332891), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).