9-[4-[3-[3-[[9-(4-tert-butyl-2-pyridinyl)-1H-carbazol-1-id-2-yl]oxy]benzene-2-id-1-yl]-2H-benzimidazol-2-id-1-yl]-6-(2,4,6-trimethylphenyl)-1,3,5-triazin-2-yl]-1,8-dimethylcarbazole;platinum

C60H49N8OPt-3 — CID 176782317

About 9-[4-[3-[3-[[9-(4-tert-butyl-2-pyridinyl)-1H-carbazol-1-id-2-yl]oxy]benzene-2-id-1-yl]-2H-benzimidazol-2-id-1-yl]-6-(2,4,6-trimethylphenyl)-1,3,5-triazin-2-yl]-1,8-dimethylcarbazole;platinum

9-[4-[3-[3-[[9-(4-tert-butyl-2-pyridinyl)-1H-carbazol-1-id-2-yl]oxy]benzene-2-id-1-yl]-2H-benzimidazol-2-id-1-yl]-6-(2,4,6-trimethylphenyl)-1,3,5-triazin-2-yl]-1,8-dimethylcarbazole;platinum (PubChem CID 176782317) has the molecular formula C60H49N8OPt-3 and a molecular weight of 1093.18 g/mol. Its IUPAC name is 9-[4-[3-[3-[[9-(4-tert-butyl-2-pyridinyl)-1H-carbazol-1-id-2-yl]oxy]benzene-2-id-1-yl]-2H-benzimidazol-2-id-1-yl]-6-(2,4,6-trimethylphenyl)-1,3,5-triazin-2-yl]-1,8-dimethylcarbazole;platinum.

Molecular Properties

• Compound Name: 9-[4-[3-[3-[[9-(4-tert-butyl-2-pyridinyl)-1H-carbazol-1-id-2-yl]oxy]benzene-2-id-1-yl]-2H-benzimidazol-2-id-1-yl]-6-(2,4,6-trimethylphenyl)-1,3,5-triazin-2-yl]-1,8-dimethylcarbazole;platinum
• PubChem CID: 176782317
• Molecular Formula: C60H49N8OPt-3
• Molecular Weight: 1093.18 g/mol
• Exact Mass: 1092.37
• IUPAC Name: 9-[4-[3-[3-[[9-(4-tert-butyl-2-pyridinyl)-1H-carbazol-1-id-2-yl]oxy]benzene-2-id-1-yl]-2H-benzimidazol-2-id-1-yl]-6-(2,4,6-trimethylphenyl)-1,3,5-triazin-2-yl]-1,8-dimethylcarbazole;platinum
• SMILES: Cc1cc(C)c(-c2nc(N3[CH-]N(c4[c-]c(Oc5[c-]c6c(cc5)c5ccccc5n6-c5cc(C(C)(C)C)ccn5)ccc4)c4ccccc43)nc(-n3c4c(C)cccc4c4cccc(C)c43)n2)c(C)c1.[Pt]
• InChI: InChI=1S/C60H49N8O.Pt/c1-36-30-39(4)54(40(5)31-36)57-62-58(64-59(63-57)68-55-37(2)16-13-21-47(55)48-22-14-17-38(3)56(48)68)66-35-65(50-24-11-12-25-51(50)66)42-18-15-19-43(33-42)69-44-26-27-46-45-20-9-10-23-49(45)67(52(46)34-44)53-32-41(28-29-61-53)60(6,7)8;/h9-32,35H,1-8H3;/q-3
• InChIKey: GMEBQZZIJFYHIS-UHFFFAOYSA-N
• XLogP: 14.77
• TPSA: 77.13 Ų
• H-Bond Acceptors: 9
• Rotatable Bonds: 7
• Heavy Atoms: 70
• Complexity: —

Lipinski Rule of Five

2 violations

Rule	Value
MW ≤ 500	1093.18
LogP ≤ 5	14.77
H-Bond Donors ≤ 5	0
H-Bond Acceptors ≤ 10	9

Computed Properties (RDKit)

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

Frequently Asked Questions

What is the IUPAC name of 9-[4-[3-[3-[[9-(4-tert-butyl-2-pyridinyl)-1H-carbazol-1-id-2-yl]oxy]benzene-2-id-1-yl]-2H-benzimidazol-2-id-1-yl]-6-(2,4,6-trimethylphenyl)-1,3,5-triazin-2-yl]-1,8-dimethylcarbazole;platinum?

The IUPAC name of 9-[4-[3-[3-[[9-(4-tert-butyl-2-pyridinyl)-1H-carbazol-1-id-2-yl]oxy]benzene-2-id-1-yl]-2H-benzimidazol-2-id-1-yl]-6-(2,4,6-trimethylphenyl)-1,3,5-triazin-2-yl]-1,8-dimethylcarbazole;platinum (CID 176782317) is 9-[4-[3-[3-[[9-(4-tert-butyl-2-pyridinyl)-1H-carbazol-1-id-2-yl]oxy]benzene-2-id-1-yl]-2H-benzimidazol-2-id-1-yl]-6-(2,4,6-trimethylphenyl)-1,3,5-triazin-2-yl]-1,8-dimethylcarbazole;platinum.

What is the SMILES notation for 9-[4-[3-[3-[[9-(4-tert-butyl-2-pyridinyl)-1H-carbazol-1-id-2-yl]oxy]benzene-2-id-1-yl]-2H-benzimidazol-2-id-1-yl]-6-(2,4,6-trimethylphenyl)-1,3,5-triazin-2-yl]-1,8-dimethylcarbazole;platinum?

The canonical SMILES for 9-[4-[3-[3-[[9-(4-tert-butyl-2-pyridinyl)-1H-carbazol-1-id-2-yl]oxy]benzene-2-id-1-yl]-2H-benzimidazol-2-id-1-yl]-6-(2,4,6-trimethylphenyl)-1,3,5-triazin-2-yl]-1,8-dimethylcarbazole;platinum is Cc1cc(C)c(-c2nc(N3[CH-]N(c4[c-]c(Oc5[c-]c6c(cc5)c5ccccc5n6-c5cc(C(C)(C)C)ccn5)ccc4)c4ccccc43)nc(-n3c4c(C)cccc4c4cccc(C)c43)n2)c(C)c1.[Pt].

What is the InChIKey of 9-[4-[3-[3-[[9-(4-tert-butyl-2-pyridinyl)-1H-carbazol-1-id-2-yl]oxy]benzene-2-id-1-yl]-2H-benzimidazol-2-id-1-yl]-6-(2,4,6-trimethylphenyl)-1,3,5-triazin-2-yl]-1,8-dimethylcarbazole;platinum?

The InChIKey is GMEBQZZIJFYHIS-UHFFFAOYSA-N. The full InChI is InChI=1S/C60H49N8O.Pt/c1-36-30-39(4)54(40(5)31-36)57-62-58(64-59(63-57)68-55-37(2)16-13-21-47(55)48-22-14-17-38(3)56(48)68)66-35-65(50-24-11-12-25-51(50)66)42-18-15-19-43(33-42)69-44-26-27-46-45-20-9-10-23-49(45)67(52(46)34-44)53-32-41(28-29-61-53)60(6,7)8;/h9-32,35H,1-8H3;/q-3;.

What are the key properties of 9-[4-[3-[3-[[9-(4-tert-butyl-2-pyridinyl)-1H-carbazol-1-id-2-yl]oxy]benzene-2-id-1-yl]-2H-benzimidazol-2-id-1-yl]-6-(2,4,6-trimethylphenyl)-1,3,5-triazin-2-yl]-1,8-dimethylcarbazole;platinum?

9-[4-[3-[3-[[9-(4-tert-butyl-2-pyridinyl)-1H-carbazol-1-id-2-yl]oxy]benzene-2-id-1-yl]-2H-benzimidazol-2-id-1-yl]-6-(2,4,6-trimethylphenyl)-1,3,5-triazin-2-yl]-1,8-dimethylcarbazole;platinum has a molecular weight of 1093.18 g/mol, XLogP of 14.77, 7 rotatable bonds, 0 hydrogen bond donors, and 9 hydrogen bond acceptors.

Where does this data come from?

All data for 9-[4-[3-[3-[[9-(4-tert-butyl-2-pyridinyl)-1H-carbazol-1-id-2-yl]oxy]benzene-2-id-1-yl]-2H-benzimidazol-2-id-1-yl]-6-(2,4,6-trimethylphenyl)-1,3,5-triazin-2-yl]-1,8-dimethylcarbazole;platinum is sourced from PubChem (CID 176782317), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).