2-[1-(2,6-dimethylphenyl)-4-[4-[2-phenyl-6-(2,4,6-trimethylphenyl)phenyl]-3H-dibenzofuran-3-id-2-yl]benzimidazol-2-yl]-5,6-dihydrobenzo[h]quinolin-10-ol;platinum

C61H46N3O2Pt- — CID 171734254

About 2-[1-(2,6-dimethylphenyl)-4-[4-[2-phenyl-6-(2,4,6-trimethylphenyl)phenyl]-3H-dibenzofuran-3-id-2-yl]benzimidazol-2-yl]-5,6-dihydrobenzo[h]quinolin-10-ol;platinum

2-[1-(2,6-dimethylphenyl)-4-[4-[2-phenyl-6-(2,4,6-trimethylphenyl)phenyl]-3H-dibenzofuran-3-id-2-yl]benzimidazol-2-yl]-5,6-dihydrobenzo[h]quinolin-10-ol;platinum (PubChem CID 171734254) has the molecular formula C61H46N3O2Pt- and a molecular weight of 1048.14 g/mol. Its IUPAC name is 2-[1-(2,6-dimethylphenyl)-4-[4-[2-phenyl-6-(2,4,6-trimethylphenyl)phenyl]-3H-dibenzofuran-3-id-2-yl]benzimidazol-2-yl]-5,6-dihydrobenzo[h]quinolin-10-ol;platinum.

Molecular Properties

• Compound Name: 2-[1-(2,6-dimethylphenyl)-4-[4-[2-phenyl-6-(2,4,6-trimethylphenyl)phenyl]-3H-dibenzofuran-3-id-2-yl]benzimidazol-2-yl]-5,6-dihydrobenzo[h]quinolin-10-ol;platinum
• PubChem CID: 171734254
• Molecular Formula: C61H46N3O2Pt-
• Molecular Weight: 1048.14 g/mol
• Exact Mass: 1047.32
• IUPAC Name: 2-[1-(2,6-dimethylphenyl)-4-[4-[2-phenyl-6-(2,4,6-trimethylphenyl)phenyl]-3H-dibenzofuran-3-id-2-yl]benzimidazol-2-yl]-5,6-dihydrobenzo[h]quinolin-10-ol;platinum
• SMILES: Cc1cc(C)c(-c2cccc(-c3ccccc3)c2-c2[c-]c(-c3cccc4c3nc(-c3ccc5c(n3)-c3c(O)cccc3CC5)n4-c3c(C)cccc3C)cc3c2oc2ccccc23)c(C)c1.[Pt]
• InChI: InChI=1S/C61H46N3O2.Pt/c1-35-31-38(4)54(39(5)32-35)47-23-13-21-44(40-17-7-6-8-18-40)56(47)49-34-43(33-48-46-20-9-10-26-53(46)66-60(48)49)45-22-14-24-51-58(45)63-61(64(51)59-36(2)15-11-16-37(59)3)50-30-29-42-28-27-41-19-12-25-52(65)55(41)57(42)62-50;/h6-26,29-33,65H,27-28H2,1-5H3;/q-1
• InChIKey: FCFAQHMLGUUHSW-UHFFFAOYSA-N
• XLogP: 15.47
• TPSA: 64.08 Ų
• H-Bond Donors: 1
• H-Bond Acceptors: 5
• Rotatable Bonds: 6
• Heavy Atoms: 67
• Complexity: —

Lipinski Rule of Five

2 violations

Rule	Value
MW ≤ 500	1048.14
LogP ≤ 5	15.47
H-Bond Donors ≤ 5	1
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 2-[1-(2,6-dimethylphenyl)-4-[4-[2-phenyl-6-(2,4,6-trimethylphenyl)phenyl]-3H-dibenzofuran-3-id-2-yl]benzimidazol-2-yl]-5,6-dihydrobenzo[h]quinolin-10-ol;platinum?

The IUPAC name of 2-[1-(2,6-dimethylphenyl)-4-[4-[2-phenyl-6-(2,4,6-trimethylphenyl)phenyl]-3H-dibenzofuran-3-id-2-yl]benzimidazol-2-yl]-5,6-dihydrobenzo[h]quinolin-10-ol;platinum (CID 171734254) is 2-[1-(2,6-dimethylphenyl)-4-[4-[2-phenyl-6-(2,4,6-trimethylphenyl)phenyl]-3H-dibenzofuran-3-id-2-yl]benzimidazol-2-yl]-5,6-dihydrobenzo[h]quinolin-10-ol;platinum.

What is the SMILES notation for 2-[1-(2,6-dimethylphenyl)-4-[4-[2-phenyl-6-(2,4,6-trimethylphenyl)phenyl]-3H-dibenzofuran-3-id-2-yl]benzimidazol-2-yl]-5,6-dihydrobenzo[h]quinolin-10-ol;platinum?

The canonical SMILES for 2-[1-(2,6-dimethylphenyl)-4-[4-[2-phenyl-6-(2,4,6-trimethylphenyl)phenyl]-3H-dibenzofuran-3-id-2-yl]benzimidazol-2-yl]-5,6-dihydrobenzo[h]quinolin-10-ol;platinum is Cc1cc(C)c(-c2cccc(-c3ccccc3)c2-c2[c-]c(-c3cccc4c3nc(-c3ccc5c(n3)-c3c(O)cccc3CC5)n4-c3c(C)cccc3C)cc3c2oc2ccccc23)c(C)c1.[Pt].

What is the InChIKey of 2-[1-(2,6-dimethylphenyl)-4-[4-[2-phenyl-6-(2,4,6-trimethylphenyl)phenyl]-3H-dibenzofuran-3-id-2-yl]benzimidazol-2-yl]-5,6-dihydrobenzo[h]quinolin-10-ol;platinum?

The InChIKey is FCFAQHMLGUUHSW-UHFFFAOYSA-N. The full InChI is InChI=1S/C61H46N3O2.Pt/c1-35-31-38(4)54(39(5)32-35)47-23-13-21-44(40-17-7-6-8-18-40)56(47)49-34-43(33-48-46-20-9-10-26-53(46)66-60(48)49)45-22-14-24-51-58(45)63-61(64(51)59-36(2)15-11-16-37(59)3)50-30-29-42-28-27-41-19-12-25-52(65)55(41)57(42)62-50;/h6-26,29-33,65H,27-28H2,1-5H3;/q-1;.

What are the key properties of 2-[1-(2,6-dimethylphenyl)-4-[4-[2-phenyl-6-(2,4,6-trimethylphenyl)phenyl]-3H-dibenzofuran-3-id-2-yl]benzimidazol-2-yl]-5,6-dihydrobenzo[h]quinolin-10-ol;platinum?

2-[1-(2,6-dimethylphenyl)-4-[4-[2-phenyl-6-(2,4,6-trimethylphenyl)phenyl]-3H-dibenzofuran-3-id-2-yl]benzimidazol-2-yl]-5,6-dihydrobenzo[h]quinolin-10-ol;platinum has a molecular weight of 1048.14 g/mol, XLogP of 15.47, 6 rotatable bonds, 1 hydrogen bond donors, and 5 hydrogen bond acceptors.

Where does this data come from?

All data for 2-[1-(2,6-dimethylphenyl)-4-[4-[2-phenyl-6-(2,4,6-trimethylphenyl)phenyl]-3H-dibenzofuran-3-id-2-yl]benzimidazol-2-yl]-5,6-dihydrobenzo[h]quinolin-10-ol;platinum is sourced from PubChem (CID 171734254), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).