2-[4-[3-tert-butyl-5-[4-(4-cyclohexylphenyl)-2-pyridinyl]benzene-6-id-1-yl]-1-(4-tert-butyl-2-phenylphenyl)benzimidazol-2-yl]-6-(2-phenylphenyl)phenol;platinum

C68H62N3OPt- — CID 164713300

About 2-[4-[3-tert-butyl-5-[4-(4-cyclohexylphenyl)-2-pyridinyl]benzene-6-id-1-yl]-1-(4-tert-butyl-2-phenylphenyl)benzimidazol-2-yl]-6-(2-phenylphenyl)phenol;platinum

2-[4-[3-tert-butyl-5-[4-(4-cyclohexylphenyl)-2-pyridinyl]benzene-6-id-1-yl]-1-(4-tert-butyl-2-phenylphenyl)benzimidazol-2-yl]-6-(2-phenylphenyl)phenol;platinum (PubChem CID 164713300) has the molecular formula C68H62N3OPt- and a molecular weight of 1132.34 g/mol. Its IUPAC name is 2-[4-[3-tert-butyl-5-[4-(4-cyclohexylphenyl)-2-pyridinyl]benzene-6-id-1-yl]-1-(4-tert-butyl-2-phenylphenyl)benzimidazol-2-yl]-6-(2-phenylphenyl)phenol;platinum.

Molecular Properties

• Compound Name: 2-[4-[3-tert-butyl-5-[4-(4-cyclohexylphenyl)-2-pyridinyl]benzene-6-id-1-yl]-1-(4-tert-butyl-2-phenylphenyl)benzimidazol-2-yl]-6-(2-phenylphenyl)phenol;platinum
• PubChem CID: 164713300
• Molecular Formula: C68H62N3OPt-
• Molecular Weight: 1132.34 g/mol
• Exact Mass: 1131.45
• IUPAC Name: 2-[4-[3-tert-butyl-5-[4-(4-cyclohexylphenyl)-2-pyridinyl]benzene-6-id-1-yl]-1-(4-tert-butyl-2-phenylphenyl)benzimidazol-2-yl]-6-(2-phenylphenyl)phenol;platinum
• SMILES: CC(C)(C)c1cc(-c2cc(-c3ccc(C4CCCCC4)cc3)ccn2)[c-]c(-c2cccc3c2nc(-c2cccc(-c4ccccc4-c4ccccc4)c2O)n3-c2ccc(C(C)(C)C)cc2-c2ccccc2)c1.[Pt]
• InChI: InChI=1S/C68H62N3O.Pt/c1-67(2,3)53-36-37-62(60(44-53)49-24-14-9-15-25-49)71-63-31-19-28-56(64(63)70-66(71)59-30-18-29-58(65(59)72)57-27-17-16-26-55(57)48-22-12-8-13-23-48)51-40-52(42-54(41-51)68(4,5)6)61-43-50(38-39-69-61)47-34-32-46(33-35-47)45-20-10-7-11-21-45;/h8-9,12-19,22-39,41-45,72H,7,10-11,20-21H2,1-6H3;/q-1
• InChIKey: PZFAJNYPOAMGPT-UHFFFAOYSA-N
• XLogP: 18.24
• TPSA: 50.94 Ų
• H-Bond Donors: 1
• H-Bond Acceptors: 4
• Rotatable Bonds: 9
• Heavy Atoms: 73
• Complexity: —

Lipinski Rule of Five

2 violations

Rule	Value
MW ≤ 500	1132.34
LogP ≤ 5	18.24
H-Bond Donors ≤ 5	1
H-Bond Acceptors ≤ 10	4

Computed Properties (RDKit)

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

Frequently Asked Questions

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

The IUPAC name of 2-[4-[3-tert-butyl-5-[4-(4-cyclohexylphenyl)-2-pyridinyl]benzene-6-id-1-yl]-1-(4-tert-butyl-2-phenylphenyl)benzimidazol-2-yl]-6-(2-phenylphenyl)phenol;platinum (CID 164713300) is 2-[4-[3-tert-butyl-5-[4-(4-cyclohexylphenyl)-2-pyridinyl]benzene-6-id-1-yl]-1-(4-tert-butyl-2-phenylphenyl)benzimidazol-2-yl]-6-(2-phenylphenyl)phenol;platinum.

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

The canonical SMILES for 2-[4-[3-tert-butyl-5-[4-(4-cyclohexylphenyl)-2-pyridinyl]benzene-6-id-1-yl]-1-(4-tert-butyl-2-phenylphenyl)benzimidazol-2-yl]-6-(2-phenylphenyl)phenol;platinum is CC(C)(C)c1cc(-c2cc(-c3ccc(C4CCCCC4)cc3)ccn2)[c-]c(-c2cccc3c2nc(-c2cccc(-c4ccccc4-c4ccccc4)c2O)n3-c2ccc(C(C)(C)C)cc2-c2ccccc2)c1.[Pt].

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

The InChIKey is PZFAJNYPOAMGPT-UHFFFAOYSA-N. The full InChI is InChI=1S/C68H62N3O.Pt/c1-67(2,3)53-36-37-62(60(44-53)49-24-14-9-15-25-49)71-63-31-19-28-56(64(63)70-66(71)59-30-18-29-58(65(59)72)57-27-17-16-26-55(57)48-22-12-8-13-23-48)51-40-52(42-54(41-51)68(4,5)6)61-43-50(38-39-69-61)47-34-32-46(33-35-47)45-20-10-7-11-21-45;/h8-9,12-19,22-39,41-45,72H,7,10-11,20-21H2,1-6H3;/q-1;.

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

2-[4-[3-tert-butyl-5-[4-(4-cyclohexylphenyl)-2-pyridinyl]benzene-6-id-1-yl]-1-(4-tert-butyl-2-phenylphenyl)benzimidazol-2-yl]-6-(2-phenylphenyl)phenol;platinum has a molecular weight of 1132.34 g/mol, XLogP of 18.24, 9 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.

Where does this data come from?

All data for 2-[4-[3-tert-butyl-5-[4-(4-cyclohexylphenyl)-2-pyridinyl]benzene-6-id-1-yl]-1-(4-tert-butyl-2-phenylphenyl)benzimidazol-2-yl]-6-(2-phenylphenyl)phenol;platinum is sourced from PubChem (CID 164713300), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).