2-[4-[3-tert-butyl-5-[4-[4-(2-phenylpropan-2-yl)phenyl]-2-pyridinyl]benzene-6-id-1-yl]-1-[4-[cyclopentyl(dideuterio)methyl]-2-phenylphenyl]benzimidazol-2-yl]-6-(2-phenylphenyl)phenol;platinum

C73H64N3OPt- — CID 164713302

About 2-[4-[3-tert-butyl-5-[4-[4-(2-phenylpropan-2-yl)phenyl]-2-pyridinyl]benzene-6-id-1-yl]-1-[4-[cyclopentyl(dideuterio)methyl]-2-phenylphenyl]benzimidazol-2-yl]-6-(2-phenylphenyl)phenol;platinum

2-[4-[3-tert-butyl-5-[4-[4-(2-phenylpropan-2-yl)phenyl]-2-pyridinyl]benzene-6-id-1-yl]-1-[4-[cyclopentyl(dideuterio)methyl]-2-phenylphenyl]benzimidazol-2-yl]-6-(2-phenylphenyl)phenol;platinum (PubChem CID 164713302) has the molecular formula C73H64N3OPt- and a molecular weight of 1196.43 g/mol. Its IUPAC name is 2-[4-[3-tert-butyl-5-[4-[4-(2-phenylpropan-2-yl)phenyl]-2-pyridinyl]benzene-6-id-1-yl]-1-[4-[cyclopentyl(dideuterio)methyl]-2-phenylphenyl]benzimidazol-2-yl]-6-(2-phenylphenyl)phenol;platinum.

Molecular Properties

• Compound Name: 2-[4-[3-tert-butyl-5-[4-[4-(2-phenylpropan-2-yl)phenyl]-2-pyridinyl]benzene-6-id-1-yl]-1-[4-[cyclopentyl(dideuterio)methyl]-2-phenylphenyl]benzimidazol-2-yl]-6-(2-phenylphenyl)phenol;platinum
• PubChem CID: 164713302
• Molecular Formula: C73H64N3OPt-
• Molecular Weight: 1196.43 g/mol
• Exact Mass: 1195.48
• IUPAC Name: 2-[4-[3-tert-butyl-5-[4-[4-(2-phenylpropan-2-yl)phenyl]-2-pyridinyl]benzene-6-id-1-yl]-1-[4-[cyclopentyl(dideuterio)methyl]-2-phenylphenyl]benzimidazol-2-yl]-6-(2-phenylphenyl)phenol;platinum
• SMILES: [2H]C([2H])(c1ccc(-n2c(-c3cccc(-c4ccccc4-c4ccccc4)c3O)nc3c(-c4[c-]c(-c5cc(-c6ccc(C(C)(C)c7ccccc7)cc6)ccn5)cc(C(C)(C)C)c4)cccc32)c(-c2ccccc2)c1)C1CCCC1.[Pt]
• InChI: InChI=1S/C73H64N3O.Pt/c1-72(2,3)59-46-55(45-56(47-59)66-48-54(41-42-74-66)51-36-38-58(39-37-51)73(4,5)57-27-13-8-14-28-57)61-31-20-34-68-69(61)75-71(64-33-19-32-63(70(64)77)62-30-18-17-29-60(62)52-23-9-6-10-24-52)76(68)67-40-35-50(43-49-21-15-16-22-49)44-65(67)53-25-11-7-12-26-53;/h6-14,17-20,23-42,44,46-49,77H,15-16,21-22,43H2,1-5H3;/q-1;/i43D2
• InChIKey: IQSPPKQUFFXYFG-CJWRXDKFSA-N
• XLogP: 18.95
• TPSA: 50.94 Ų
• H-Bond Donors: 1
• H-Bond Acceptors: 4
• Rotatable Bonds: 12
• Heavy Atoms: 78
• Complexity: —

Lipinski Rule of Five

2 violations

Rule	Value
MW ≤ 500	1196.43
LogP ≤ 5	18.95
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-(2-phenylpropan-2-yl)phenyl]-2-pyridinyl]benzene-6-id-1-yl]-1-[4-[cyclopentyl(dideuterio)methyl]-2-phenylphenyl]benzimidazol-2-yl]-6-(2-phenylphenyl)phenol;platinum?

The IUPAC name of 2-[4-[3-tert-butyl-5-[4-[4-(2-phenylpropan-2-yl)phenyl]-2-pyridinyl]benzene-6-id-1-yl]-1-[4-[cyclopentyl(dideuterio)methyl]-2-phenylphenyl]benzimidazol-2-yl]-6-(2-phenylphenyl)phenol;platinum (CID 164713302) is 2-[4-[3-tert-butyl-5-[4-[4-(2-phenylpropan-2-yl)phenyl]-2-pyridinyl]benzene-6-id-1-yl]-1-[4-[cyclopentyl(dideuterio)methyl]-2-phenylphenyl]benzimidazol-2-yl]-6-(2-phenylphenyl)phenol;platinum.

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

The canonical SMILES for 2-[4-[3-tert-butyl-5-[4-[4-(2-phenylpropan-2-yl)phenyl]-2-pyridinyl]benzene-6-id-1-yl]-1-[4-[cyclopentyl(dideuterio)methyl]-2-phenylphenyl]benzimidazol-2-yl]-6-(2-phenylphenyl)phenol;platinum is [2H]C([2H])(c1ccc(-n2c(-c3cccc(-c4ccccc4-c4ccccc4)c3O)nc3c(-c4[c-]c(-c5cc(-c6ccc(C(C)(C)c7ccccc7)cc6)ccn5)cc(C(C)(C)C)c4)cccc32)c(-c2ccccc2)c1)C1CCCC1.[Pt].

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

The InChIKey is IQSPPKQUFFXYFG-CJWRXDKFSA-N. The full InChI is InChI=1S/C73H64N3O.Pt/c1-72(2,3)59-46-55(45-56(47-59)66-48-54(41-42-74-66)51-36-38-58(39-37-51)73(4,5)57-27-13-8-14-28-57)61-31-20-34-68-69(61)75-71(64-33-19-32-63(70(64)77)62-30-18-17-29-60(62)52-23-9-6-10-24-52)76(68)67-40-35-50(43-49-21-15-16-22-49)44-65(67)53-25-11-7-12-26-53;/h6-14,17-20,23-42,44,46-49,77H,15-16,21-22,43H2,1-5H3;/q-1;/i43D2;.

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

2-[4-[3-tert-butyl-5-[4-[4-(2-phenylpropan-2-yl)phenyl]-2-pyridinyl]benzene-6-id-1-yl]-1-[4-[cyclopentyl(dideuterio)methyl]-2-phenylphenyl]benzimidazol-2-yl]-6-(2-phenylphenyl)phenol;platinum has a molecular weight of 1196.43 g/mol, XLogP of 18.95, 12 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-(2-phenylpropan-2-yl)phenyl]-2-pyridinyl]benzene-6-id-1-yl]-1-[4-[cyclopentyl(dideuterio)methyl]-2-phenylphenyl]benzimidazol-2-yl]-6-(2-phenylphenyl)phenol;platinum is sourced from PubChem (CID 164713302), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).