2-[1-(3-tert-butyl-4-phenylphenyl)-4-[3-tert-butyl-5-[3,5,6-trideuterio-4-(2,3,4,5,6-pentadeuteriophenyl)-2-pyridinyl]benzene-6-id-1-yl]benzimidazol-2-yl]-4,6-di(propan-2-yl)phenol;platinum

C56H56N3OPt- — CID 153476492

About 2-[1-(3-tert-butyl-4-phenylphenyl)-4-[3-tert-butyl-5-[3,5,6-trideuterio-4-(2,3,4,5,6-pentadeuteriophenyl)-2-pyridinyl]benzene-6-id-1-yl]benzimidazol-2-yl]-4,6-di(propan-2-yl)phenol;platinum

2-[1-(3-tert-butyl-4-phenylphenyl)-4-[3-tert-butyl-5-[3,5,6-trideuterio-4-(2,3,4,5,6-pentadeuteriophenyl)-2-pyridinyl]benzene-6-id-1-yl]benzimidazol-2-yl]-4,6-di(propan-2-yl)phenol;platinum (PubChem CID 153476492) has the molecular formula C56H56N3OPt- and a molecular weight of 990.21 g/mol. Its IUPAC name is 2-[1-(3-tert-butyl-4-phenylphenyl)-4-[3-tert-butyl-5-[3,5,6-trideuterio-4-(2,3,4,5,6-pentadeuteriophenyl)-2-pyridinyl]benzene-6-id-1-yl]benzimidazol-2-yl]-4,6-di(propan-2-yl)phenol;platinum.

Molecular Properties

• Compound Name: 2-[1-(3-tert-butyl-4-phenylphenyl)-4-[3-tert-butyl-5-[3,5,6-trideuterio-4-(2,3,4,5,6-pentadeuteriophenyl)-2-pyridinyl]benzene-6-id-1-yl]benzimidazol-2-yl]-4,6-di(propan-2-yl)phenol;platinum
• PubChem CID: 153476492
• Molecular Formula: C56H56N3OPt-
• Molecular Weight: 990.21 g/mol
• Exact Mass: 989.46
• IUPAC Name: 2-[1-(3-tert-butyl-4-phenylphenyl)-4-[3-tert-butyl-5-[3,5,6-trideuterio-4-(2,3,4,5,6-pentadeuteriophenyl)-2-pyridinyl]benzene-6-id-1-yl]benzimidazol-2-yl]-4,6-di(propan-2-yl)phenol;platinum
• SMILES: [2H]c1nc(-c2[c-]c(-c3cccc4c3nc(-c3cc(C(C)C)cc(C(C)C)c3O)n4-c3ccc(-c4ccccc4)c(C(C)(C)C)c3)cc(C(C)(C)C)c2)c([2H])c(-c2c([2H])c([2H])c([2H])c([2H])c2[2H])c1[2H].[Pt]
• InChI: InChI=1S/C56H56N3O.Pt/c1-35(2)40-31-47(36(3)4)53(60)48(32-40)54-58-52-46(22-17-23-51(52)59(54)44-24-25-45(38-20-15-12-16-21-38)49(34-44)56(8,9)10)41-28-42(30-43(29-41)55(5,6)7)50-33-39(26-27-57-50)37-18-13-11-14-19-37;/h11-27,29-36,60H,1-10H3;/q-1;/i11D,13D,14D,18D,19D,26D,27D,33D
• InChIKey: OBUYUTVXANJDHL-LMQDRXFFSA-N
• XLogP: 15.10
• TPSA: 50.94 Ų
• H-Bond Donors: 1
• H-Bond Acceptors: 4
• Rotatable Bonds: 8
• Heavy Atoms: 61
• Complexity: —

Lipinski Rule of Five

2 violations

Rule	Value
MW ≤ 500	990.21
LogP ≤ 5	15.10
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-(3-tert-butyl-4-phenylphenyl)-4-[3-tert-butyl-5-[3,5,6-trideuterio-4-(2,3,4,5,6-pentadeuteriophenyl)-2-pyridinyl]benzene-6-id-1-yl]benzimidazol-2-yl]-4,6-di(propan-2-yl)phenol;platinum?

The IUPAC name of 2-[1-(3-tert-butyl-4-phenylphenyl)-4-[3-tert-butyl-5-[3,5,6-trideuterio-4-(2,3,4,5,6-pentadeuteriophenyl)-2-pyridinyl]benzene-6-id-1-yl]benzimidazol-2-yl]-4,6-di(propan-2-yl)phenol;platinum (CID 153476492) is 2-[1-(3-tert-butyl-4-phenylphenyl)-4-[3-tert-butyl-5-[3,5,6-trideuterio-4-(2,3,4,5,6-pentadeuteriophenyl)-2-pyridinyl]benzene-6-id-1-yl]benzimidazol-2-yl]-4,6-di(propan-2-yl)phenol;platinum.

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

The canonical SMILES for 2-[1-(3-tert-butyl-4-phenylphenyl)-4-[3-tert-butyl-5-[3,5,6-trideuterio-4-(2,3,4,5,6-pentadeuteriophenyl)-2-pyridinyl]benzene-6-id-1-yl]benzimidazol-2-yl]-4,6-di(propan-2-yl)phenol;platinum is [2H]c1nc(-c2[c-]c(-c3cccc4c3nc(-c3cc(C(C)C)cc(C(C)C)c3O)n4-c3ccc(-c4ccccc4)c(C(C)(C)C)c3)cc(C(C)(C)C)c2)c([2H])c(-c2c([2H])c([2H])c([2H])c([2H])c2[2H])c1[2H].[Pt].

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

The InChIKey is OBUYUTVXANJDHL-LMQDRXFFSA-N. The full InChI is InChI=1S/C56H56N3O.Pt/c1-35(2)40-31-47(36(3)4)53(60)48(32-40)54-58-52-46(22-17-23-51(52)59(54)44-24-25-45(38-20-15-12-16-21-38)49(34-44)56(8,9)10)41-28-42(30-43(29-41)55(5,6)7)50-33-39(26-27-57-50)37-18-13-11-14-19-37;/h11-27,29-36,60H,1-10H3;/q-1;/i11D,13D,14D,18D,19D,26D,27D,33D;.

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

2-[1-(3-tert-butyl-4-phenylphenyl)-4-[3-tert-butyl-5-[3,5,6-trideuterio-4-(2,3,4,5,6-pentadeuteriophenyl)-2-pyridinyl]benzene-6-id-1-yl]benzimidazol-2-yl]-4,6-di(propan-2-yl)phenol;platinum has a molecular weight of 990.21 g/mol, XLogP of 15.10, 8 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.

Where does this data come from?

All data for 2-[1-(3-tert-butyl-4-phenylphenyl)-4-[3-tert-butyl-5-[3,5,6-trideuterio-4-(2,3,4,5,6-pentadeuteriophenyl)-2-pyridinyl]benzene-6-id-1-yl]benzimidazol-2-yl]-4,6-di(propan-2-yl)phenol;platinum is sourced from PubChem (CID 153476492), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).