2-[1-(2,6-diphenylphenyl)-4-quinolin-8-ylimidazol-2-yl]-1H-phenanthridin-1-id-10-ol;platinum

C43H27N4OPt- — CID 170685809

About 2-[1-(2,6-diphenylphenyl)-4-quinolin-8-ylimidazol-2-yl]-1H-phenanthridin-1-id-10-ol;platinum

2-[1-(2,6-diphenylphenyl)-4-quinolin-8-ylimidazol-2-yl]-1H-phenanthridin-1-id-10-ol;platinum (PubChem CID 170685809) has the molecular formula C43H27N4OPt- and a molecular weight of 810.79 g/mol. Its IUPAC name is 2-[1-(2,6-diphenylphenyl)-4-quinolin-8-ylimidazol-2-yl]-1H-phenanthridin-1-id-10-ol;platinum.

Molecular Properties

• Compound Name: 2-[1-(2,6-diphenylphenyl)-4-quinolin-8-ylimidazol-2-yl]-1H-phenanthridin-1-id-10-ol;platinum
• PubChem CID: 170685809
• Molecular Formula: C43H27N4OPt-
• Molecular Weight: 810.79 g/mol
• Exact Mass: 810.18
• IUPAC Name: 2-[1-(2,6-diphenylphenyl)-4-quinolin-8-ylimidazol-2-yl]-1H-phenanthridin-1-id-10-ol;platinum
• SMILES: Oc1cccc2cnc3ccc(-c4nc(-c5cccc6cccnc56)cn4-c4c(-c5ccccc5)cccc4-c4ccccc4)[c-]c3c12.[Pt]
• InChI: InChI=1S/C43H27N4O.Pt/c48-39-21-8-16-32-26-45-37-23-22-31(25-36(37)40(32)39)43-46-38(35-20-7-15-30-17-10-24-44-41(30)35)27-47(43)42-33(28-11-3-1-4-12-28)18-9-19-34(42)29-13-5-2-6-14-29;/h1-24,26-27,48H;/q-1
• InChIKey: QPQWIVDWLIPWNG-UHFFFAOYSA-N
• XLogP: 10.29
• TPSA: 63.83 Ų
• H-Bond Donors: 1
• H-Bond Acceptors: 5
• Rotatable Bonds: 5
• Heavy Atoms: 49
• Complexity: —

Lipinski Rule of Five

2 violations

Rule	Value
MW ≤ 500	810.79
LogP ≤ 5	10.29
H-Bond Donors ≤ 5	1
H-Bond Acceptors ≤ 10	5

Computed Properties (RDKit)

• Structural Alerts: {'alert_name': 'Carbo_cation/anion', 'substructure': 'N/A'}, {'alert_name': 'Polycyclic_aromatic_hydrocarbon_3', 'substructure': 'N/A'}

Frequently Asked Questions

What is the IUPAC name of 2-[1-(2,6-diphenylphenyl)-4-quinolin-8-ylimidazol-2-yl]-1H-phenanthridin-1-id-10-ol;platinum?

The IUPAC name of 2-[1-(2,6-diphenylphenyl)-4-quinolin-8-ylimidazol-2-yl]-1H-phenanthridin-1-id-10-ol;platinum (CID 170685809) is 2-[1-(2,6-diphenylphenyl)-4-quinolin-8-ylimidazol-2-yl]-1H-phenanthridin-1-id-10-ol;platinum.

What is the SMILES notation for 2-[1-(2,6-diphenylphenyl)-4-quinolin-8-ylimidazol-2-yl]-1H-phenanthridin-1-id-10-ol;platinum?

The canonical SMILES for 2-[1-(2,6-diphenylphenyl)-4-quinolin-8-ylimidazol-2-yl]-1H-phenanthridin-1-id-10-ol;platinum is Oc1cccc2cnc3ccc(-c4nc(-c5cccc6cccnc56)cn4-c4c(-c5ccccc5)cccc4-c4ccccc4)[c-]c3c12.[Pt].

What is the InChIKey of 2-[1-(2,6-diphenylphenyl)-4-quinolin-8-ylimidazol-2-yl]-1H-phenanthridin-1-id-10-ol;platinum?

The InChIKey is QPQWIVDWLIPWNG-UHFFFAOYSA-N. The full InChI is InChI=1S/C43H27N4O.Pt/c48-39-21-8-16-32-26-45-37-23-22-31(25-36(37)40(32)39)43-46-38(35-20-7-15-30-17-10-24-44-41(30)35)27-47(43)42-33(28-11-3-1-4-12-28)18-9-19-34(42)29-13-5-2-6-14-29;/h1-24,26-27,48H;/q-1;.

What are the key properties of 2-[1-(2,6-diphenylphenyl)-4-quinolin-8-ylimidazol-2-yl]-1H-phenanthridin-1-id-10-ol;platinum?

2-[1-(2,6-diphenylphenyl)-4-quinolin-8-ylimidazol-2-yl]-1H-phenanthridin-1-id-10-ol;platinum has a molecular weight of 810.79 g/mol, XLogP of 10.29, 5 rotatable bonds, 1 hydrogen bond donors, and 5 hydrogen bond acceptors.

Where does this data come from?

All data for 2-[1-(2,6-diphenylphenyl)-4-quinolin-8-ylimidazol-2-yl]-1H-phenanthridin-1-id-10-ol;platinum is sourced from PubChem (CID 170685809), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).