5-[dideuterio(fluoro)methyl]-1-[4-phenyl-2,6-di(propan-2-yl)phenyl]-2-[3-[3-[1-[4-phenyl-2,6-di(propan-2-yl)phenyl]benzimidazol-2-yl]benzene-2-id-1-yl]oxy-2H-naphthalen-2-id-1-yl]benzimidazole;platinum(2+)

C67H59FN4OPt — CID 177293847

About 5-[dideuterio(fluoro)methyl]-1-[4-phenyl-2,6-di(propan-2-yl)phenyl]-2-[3-[3-[1-[4-phenyl-2,6-di(propan-2-yl)phenyl]benzimidazol-2-yl]benzene-2-id-1-yl]oxy-2H-naphthalen-2-id-1-yl]benzimidazole;platinum(2+)

5-[dideuterio(fluoro)methyl]-1-[4-phenyl-2,6-di(propan-2-yl)phenyl]-2-[3-[3-[1-[4-phenyl-2,6-di(propan-2-yl)phenyl]benzimidazol-2-yl]benzene-2-id-1-yl]oxy-2H-naphthalen-2-id-1-yl]benzimidazole;platinum(2+) (PubChem CID 177293847) has the molecular formula C67H59FN4OPt and a molecular weight of 1152.32 g/mol. Its IUPAC name is 5-[dideuterio(fluoro)methyl]-1-[4-phenyl-2,6-di(propan-2-yl)phenyl]-2-[3-[3-[1-[4-phenyl-2,6-di(propan-2-yl)phenyl]benzimidazol-2-yl]benzene-2-id-1-yl]oxy-2H-naphthalen-2-id-1-yl]benzimidazole;platinum(2+).

Molecular Properties

• Compound Name: 5-[dideuterio(fluoro)methyl]-1-[4-phenyl-2,6-di(propan-2-yl)phenyl]-2-[3-[3-[1-[4-phenyl-2,6-di(propan-2-yl)phenyl]benzimidazol-2-yl]benzene-2-id-1-yl]oxy-2H-naphthalen-2-id-1-yl]benzimidazole;platinum(2+)
• PubChem CID: 177293847
• Molecular Formula: C67H59FN4OPt
• Molecular Weight: 1152.32 g/mol
• Exact Mass: 1151.44
• IUPAC Name: 5-[dideuterio(fluoro)methyl]-1-[4-phenyl-2,6-di(propan-2-yl)phenyl]-2-[3-[3-[1-[4-phenyl-2,6-di(propan-2-yl)phenyl]benzimidazol-2-yl]benzene-2-id-1-yl]oxy-2H-naphthalen-2-id-1-yl]benzimidazole;platinum(2+)
• SMILES: [2H]C([2H])(F)c1ccc2c(c1)nc(-c1[c-]c(Oc3[c-]c(-c4nc5ccccc5n4-c4c(C(C)C)cc(-c5ccccc5)cc4C(C)C)ccc3)cc3ccccc13)n2-c1c(C(C)C)cc(-c2ccccc2)cc1C(C)C.[Pt+2]
• InChI: InChI=1S/C67H59FN4O.Pt/c1-41(2)55-35-50(46-20-11-9-12-21-46)36-56(42(3)4)64(55)71-62-29-18-17-28-60(62)69-66(71)49-25-19-26-52(34-49)73-53-33-48-24-15-16-27-54(48)59(39-53)67-70-61-32-45(40-68)30-31-63(61)72(67)65-57(43(5)6)37-51(38-58(65)44(7)8)47-22-13-10-14-23-47;/h9-33,35-38,41-44H,40H2,1-8H3;/q-2;+2/i40D2
• InChIKey: SFEIBXWLOADXLD-SRYWVZJHSA-N
• XLogP: 18.54
• TPSA: 44.87 Ų
• H-Bond Acceptors: 5
• Rotatable Bonds: 13
• Heavy Atoms: 74
• Complexity: —

Lipinski Rule of Five

2 violations

Rule	Value
MW ≤ 500	1152.32
LogP ≤ 5	18.54
H-Bond Donors ≤ 5	0
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 5-[dideuterio(fluoro)methyl]-1-[4-phenyl-2,6-di(propan-2-yl)phenyl]-2-[3-[3-[1-[4-phenyl-2,6-di(propan-2-yl)phenyl]benzimidazol-2-yl]benzene-2-id-1-yl]oxy-2H-naphthalen-2-id-1-yl]benzimidazole;platinum(2+)?

The IUPAC name of 5-[dideuterio(fluoro)methyl]-1-[4-phenyl-2,6-di(propan-2-yl)phenyl]-2-[3-[3-[1-[4-phenyl-2,6-di(propan-2-yl)phenyl]benzimidazol-2-yl]benzene-2-id-1-yl]oxy-2H-naphthalen-2-id-1-yl]benzimidazole;platinum(2+) (CID 177293847) is 5-[dideuterio(fluoro)methyl]-1-[4-phenyl-2,6-di(propan-2-yl)phenyl]-2-[3-[3-[1-[4-phenyl-2,6-di(propan-2-yl)phenyl]benzimidazol-2-yl]benzene-2-id-1-yl]oxy-2H-naphthalen-2-id-1-yl]benzimidazole;platinum(2+).

What is the SMILES notation for 5-[dideuterio(fluoro)methyl]-1-[4-phenyl-2,6-di(propan-2-yl)phenyl]-2-[3-[3-[1-[4-phenyl-2,6-di(propan-2-yl)phenyl]benzimidazol-2-yl]benzene-2-id-1-yl]oxy-2H-naphthalen-2-id-1-yl]benzimidazole;platinum(2+)?

The canonical SMILES for 5-[dideuterio(fluoro)methyl]-1-[4-phenyl-2,6-di(propan-2-yl)phenyl]-2-[3-[3-[1-[4-phenyl-2,6-di(propan-2-yl)phenyl]benzimidazol-2-yl]benzene-2-id-1-yl]oxy-2H-naphthalen-2-id-1-yl]benzimidazole;platinum(2+) is [2H]C([2H])(F)c1ccc2c(c1)nc(-c1[c-]c(Oc3[c-]c(-c4nc5ccccc5n4-c4c(C(C)C)cc(-c5ccccc5)cc4C(C)C)ccc3)cc3ccccc13)n2-c1c(C(C)C)cc(-c2ccccc2)cc1C(C)C.[Pt+2].

What is the InChIKey of 5-[dideuterio(fluoro)methyl]-1-[4-phenyl-2,6-di(propan-2-yl)phenyl]-2-[3-[3-[1-[4-phenyl-2,6-di(propan-2-yl)phenyl]benzimidazol-2-yl]benzene-2-id-1-yl]oxy-2H-naphthalen-2-id-1-yl]benzimidazole;platinum(2+)?

The InChIKey is SFEIBXWLOADXLD-SRYWVZJHSA-N. The full InChI is InChI=1S/C67H59FN4O.Pt/c1-41(2)55-35-50(46-20-11-9-12-21-46)36-56(42(3)4)64(55)71-62-29-18-17-28-60(62)69-66(71)49-25-19-26-52(34-49)73-53-33-48-24-15-16-27-54(48)59(39-53)67-70-61-32-45(40-68)30-31-63(61)72(67)65-57(43(5)6)37-51(38-58(65)44(7)8)47-22-13-10-14-23-47;/h9-33,35-38,41-44H,40H2,1-8H3;/q-2;+2/i40D2;.

What are the key properties of 5-[dideuterio(fluoro)methyl]-1-[4-phenyl-2,6-di(propan-2-yl)phenyl]-2-[3-[3-[1-[4-phenyl-2,6-di(propan-2-yl)phenyl]benzimidazol-2-yl]benzene-2-id-1-yl]oxy-2H-naphthalen-2-id-1-yl]benzimidazole;platinum(2+)?

5-[dideuterio(fluoro)methyl]-1-[4-phenyl-2,6-di(propan-2-yl)phenyl]-2-[3-[3-[1-[4-phenyl-2,6-di(propan-2-yl)phenyl]benzimidazol-2-yl]benzene-2-id-1-yl]oxy-2H-naphthalen-2-id-1-yl]benzimidazole;platinum(2+) has a molecular weight of 1152.32 g/mol, XLogP of 18.54, 13 rotatable bonds, 0 hydrogen bond donors, and 5 hydrogen bond acceptors.

Where does this data come from?

All data for 5-[dideuterio(fluoro)methyl]-1-[4-phenyl-2,6-di(propan-2-yl)phenyl]-2-[3-[3-[1-[4-phenyl-2,6-di(propan-2-yl)phenyl]benzimidazol-2-yl]benzene-2-id-1-yl]oxy-2H-naphthalen-2-id-1-yl]benzimidazole;platinum(2+) is sourced from PubChem (CID 177293847), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).