2-[1-(4-tert-butyl-2-phenylphenyl)-4-[3-[4-(4-tert-butyl-2,3,5,6-tetradeuteriophenyl)-2-pyridinyl]-5-[1,1,1,3,3,3-hexadeuterio-2-(trideuteriomethyl)propan-2-yl]benzene-2-id-1-yl]benzimidazol-2-yl]-3,5-dideuterio-4,6-bis[1,1,1,3,3,3-hexadeuterio-2-(trideuteriomethyl)propan-2-yl]phenol;platinum

C62H68N3OPt- — CID 171425014

About 2-[1-(4-tert-butyl-2-phenylphenyl)-4-[3-[4-(4-tert-butyl-2,3,5,6-tetradeuteriophenyl)-2-pyridinyl]-5-[1,1,1,3,3,3-hexadeuterio-2-(trideuteriomethyl)propan-2-yl]benzene-2-id-1-yl]benzimidazol-2-yl]-3,5-dideuterio-4,6-bis[1,1,1,3,3,3-hexadeuterio-2-(trideuteriomethyl)propan-2-yl]phenol;platinum

2-[1-(4-tert-butyl-2-phenylphenyl)-4-[3-[4-(4-tert-butyl-2,3,5,6-tetradeuteriophenyl)-2-pyridinyl]-5-[1,1,1,3,3,3-hexadeuterio-2-(trideuteriomethyl)propan-2-yl]benzene-2-id-1-yl]benzimidazol-2-yl]-3,5-dideuterio-4,6-bis[1,1,1,3,3,3-hexadeuterio-2-(trideuteriomethyl)propan-2-yl]phenol;platinum (PubChem CID 171425014) has the molecular formula C62H68N3OPt- and a molecular weight of 1099.53 g/mol. Its IUPAC name is 2-[1-(4-tert-butyl-2-phenylphenyl)-4-[3-[4-(4-tert-butyl-2,3,5,6-tetradeuteriophenyl)-2-pyridinyl]-5-[1,1,1,3,3,3-hexadeuterio-2-(trideuteriomethyl)propan-2-yl]benzene-2-id-1-yl]benzimidazol-2-yl]-3,5-dideuterio-4,6-bis[1,1,1,3,3,3-hexadeuterio-2-(trideuteriomethyl)propan-2-yl]phenol;platinum.

Molecular Properties

• Compound Name: 2-[1-(4-tert-butyl-2-phenylphenyl)-4-[3-[4-(4-tert-butyl-2,3,5,6-tetradeuteriophenyl)-2-pyridinyl]-5-[1,1,1,3,3,3-hexadeuterio-2-(trideuteriomethyl)propan-2-yl]benzene-2-id-1-yl]benzimidazol-2-yl]-3,5-dideuterio-4,6-bis[1,1,1,3,3,3-hexadeuterio-2-(trideuteriomethyl)propan-2-yl]phenol;platinum
• PubChem CID: 171425014
• Molecular Formula: C62H68N3OPt-
• Molecular Weight: 1099.53 g/mol
• Exact Mass: 1098.71
• IUPAC Name: 2-[1-(4-tert-butyl-2-phenylphenyl)-4-[3-[4-(4-tert-butyl-2,3,5,6-tetradeuteriophenyl)-2-pyridinyl]-5-[1,1,1,3,3,3-hexadeuterio-2-(trideuteriomethyl)propan-2-yl]benzene-2-id-1-yl]benzimidazol-2-yl]-3,5-dideuterio-4,6-bis[1,1,1,3,3,3-hexadeuterio-2-(trideuteriomethyl)propan-2-yl]phenol;platinum
• SMILES: [2H]c1c([2H])c(C(C)(C)C)c([2H])c([2H])c1-c1ccnc(-c2[c-]c(-c3cccc4c3nc(-c3c([2H])c(C(C([2H])([2H])[2H])(C([2H])([2H])[2H])C([2H])([2H])[2H])c([2H])c(C(C([2H])([2H])[2H])(C([2H])([2H])[2H])C([2H])([2H])[2H])c3O)n4-c3ccc(C(C)(C)C)cc3-c3ccccc3)cc(C(C([2H])([2H])[2H])(C([2H])([2H])[2H])C([2H])([2H])[2H])c2)c1.[Pt]
• InChI: InChI=1S/C62H68N3O.Pt/c1-58(2,3)44-26-24-39(25-27-44)41-30-31-63-52(35-41)43-32-42(33-46(34-43)60(7,8)9)48-22-19-23-54-55(48)64-57(50-37-47(61(10,11)12)38-51(56(50)66)62(13,14)15)65(54)53-29-28-45(59(4,5)6)36-49(53)40-20-17-16-18-21-40;/h16-31,33-38,66H,1-15H3;/q-1;/i7D3,8D3,9D3,10D3,11D3,12D3,13D3,14D3,15D3,24D,25D,26D,27D,37D,38D
• InChIKey: FGMHBDBXMPOUOT-WPMFEPICSA-N
• XLogP: 16.75
• TPSA: 50.94 Ų
• H-Bond Donors: 1
• H-Bond Acceptors: 4
• Rotatable Bonds: 6
• Heavy Atoms: 67
• Complexity: —

Lipinski Rule of Five

2 violations

Rule	Value
MW ≤ 500	1099.53
LogP ≤ 5	16.75
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-[1-(4-tert-butyl-2-phenylphenyl)-4-[3-[4-(4-tert-butyl-2,3,5,6-tetradeuteriophenyl)-2-pyridinyl]-5-[1,1,1,3,3,3-hexadeuterio-2-(trideuteriomethyl)propan-2-yl]benzene-2-id-1-yl]benzimidazol-2-yl]-3,5-dideuterio-4,6-bis[1,1,1,3,3,3-hexadeuterio-2-(trideuteriomethyl)propan-2-yl]phenol;platinum?

The IUPAC name of 2-[1-(4-tert-butyl-2-phenylphenyl)-4-[3-[4-(4-tert-butyl-2,3,5,6-tetradeuteriophenyl)-2-pyridinyl]-5-[1,1,1,3,3,3-hexadeuterio-2-(trideuteriomethyl)propan-2-yl]benzene-2-id-1-yl]benzimidazol-2-yl]-3,5-dideuterio-4,6-bis[1,1,1,3,3,3-hexadeuterio-2-(trideuteriomethyl)propan-2-yl]phenol;platinum (CID 171425014) is 2-[1-(4-tert-butyl-2-phenylphenyl)-4-[3-[4-(4-tert-butyl-2,3,5,6-tetradeuteriophenyl)-2-pyridinyl]-5-[1,1,1,3,3,3-hexadeuterio-2-(trideuteriomethyl)propan-2-yl]benzene-2-id-1-yl]benzimidazol-2-yl]-3,5-dideuterio-4,6-bis[1,1,1,3,3,3-hexadeuterio-2-(trideuteriomethyl)propan-2-yl]phenol;platinum.

What is the SMILES notation for 2-[1-(4-tert-butyl-2-phenylphenyl)-4-[3-[4-(4-tert-butyl-2,3,5,6-tetradeuteriophenyl)-2-pyridinyl]-5-[1,1,1,3,3,3-hexadeuterio-2-(trideuteriomethyl)propan-2-yl]benzene-2-id-1-yl]benzimidazol-2-yl]-3,5-dideuterio-4,6-bis[1,1,1,3,3,3-hexadeuterio-2-(trideuteriomethyl)propan-2-yl]phenol;platinum?

The canonical SMILES for 2-[1-(4-tert-butyl-2-phenylphenyl)-4-[3-[4-(4-tert-butyl-2,3,5,6-tetradeuteriophenyl)-2-pyridinyl]-5-[1,1,1,3,3,3-hexadeuterio-2-(trideuteriomethyl)propan-2-yl]benzene-2-id-1-yl]benzimidazol-2-yl]-3,5-dideuterio-4,6-bis[1,1,1,3,3,3-hexadeuterio-2-(trideuteriomethyl)propan-2-yl]phenol;platinum is [2H]c1c([2H])c(C(C)(C)C)c([2H])c([2H])c1-c1ccnc(-c2[c-]c(-c3cccc4c3nc(-c3c([2H])c(C(C([2H])([2H])[2H])(C([2H])([2H])[2H])C([2H])([2H])[2H])c([2H])c(C(C([2H])([2H])[2H])(C([2H])([2H])[2H])C([2H])([2H])[2H])c3O)n4-c3ccc(C(C)(C)C)cc3-c3ccccc3)cc(C(C([2H])([2H])[2H])(C([2H])([2H])[2H])C([2H])([2H])[2H])c2)c1.[Pt].

What is the InChIKey of 2-[1-(4-tert-butyl-2-phenylphenyl)-4-[3-[4-(4-tert-butyl-2,3,5,6-tetradeuteriophenyl)-2-pyridinyl]-5-[1,1,1,3,3,3-hexadeuterio-2-(trideuteriomethyl)propan-2-yl]benzene-2-id-1-yl]benzimidazol-2-yl]-3,5-dideuterio-4,6-bis[1,1,1,3,3,3-hexadeuterio-2-(trideuteriomethyl)propan-2-yl]phenol;platinum?

The InChIKey is FGMHBDBXMPOUOT-WPMFEPICSA-N. The full InChI is InChI=1S/C62H68N3O.Pt/c1-58(2,3)44-26-24-39(25-27-44)41-30-31-63-52(35-41)43-32-42(33-46(34-43)60(7,8)9)48-22-19-23-54-55(48)64-57(50-37-47(61(10,11)12)38-51(56(50)66)62(13,14)15)65(54)53-29-28-45(59(4,5)6)36-49(53)40-20-17-16-18-21-40;/h16-31,33-38,66H,1-15H3;/q-1;/i7D3,8D3,9D3,10D3,11D3,12D3,13D3,14D3,15D3,24D,25D,26D,27D,37D,38D;.

What are the key properties of 2-[1-(4-tert-butyl-2-phenylphenyl)-4-[3-[4-(4-tert-butyl-2,3,5,6-tetradeuteriophenyl)-2-pyridinyl]-5-[1,1,1,3,3,3-hexadeuterio-2-(trideuteriomethyl)propan-2-yl]benzene-2-id-1-yl]benzimidazol-2-yl]-3,5-dideuterio-4,6-bis[1,1,1,3,3,3-hexadeuterio-2-(trideuteriomethyl)propan-2-yl]phenol;platinum?

2-[1-(4-tert-butyl-2-phenylphenyl)-4-[3-[4-(4-tert-butyl-2,3,5,6-tetradeuteriophenyl)-2-pyridinyl]-5-[1,1,1,3,3,3-hexadeuterio-2-(trideuteriomethyl)propan-2-yl]benzene-2-id-1-yl]benzimidazol-2-yl]-3,5-dideuterio-4,6-bis[1,1,1,3,3,3-hexadeuterio-2-(trideuteriomethyl)propan-2-yl]phenol;platinum has a molecular weight of 1099.53 g/mol, XLogP of 16.75, 6 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.

Where does this data come from?

All data for 2-[1-(4-tert-butyl-2-phenylphenyl)-4-[3-[4-(4-tert-butyl-2,3,5,6-tetradeuteriophenyl)-2-pyridinyl]-5-[1,1,1,3,3,3-hexadeuterio-2-(trideuteriomethyl)propan-2-yl]benzene-2-id-1-yl]benzimidazol-2-yl]-3,5-dideuterio-4,6-bis[1,1,1,3,3,3-hexadeuterio-2-(trideuteriomethyl)propan-2-yl]phenol;platinum is sourced from PubChem (CID 171425014), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).