2-[[9-(4-phenyl-2-pyridinyl)-1H-carbazol-1-id-2-yl]oxy]benzo[g]quinolin-10-ol;platinum

C36H22N3O2Pt- — CID 176606872

About 2-[[9-(4-phenyl-2-pyridinyl)-1H-carbazol-1-id-2-yl]oxy]benzo[g]quinolin-10-ol;platinum

2-[[9-(4-phenyl-2-pyridinyl)-1H-carbazol-1-id-2-yl]oxy]benzo[g]quinolin-10-ol;platinum (PubChem CID 176606872) has the molecular formula C36H22N3O2Pt- and a molecular weight of 723.67 g/mol. Its IUPAC name is 2-[[9-(4-phenyl-2-pyridinyl)-1H-carbazol-1-id-2-yl]oxy]benzo[g]quinolin-10-ol;platinum.

Molecular Properties

• Compound Name: 2-[[9-(4-phenyl-2-pyridinyl)-1H-carbazol-1-id-2-yl]oxy]benzo[g]quinolin-10-ol;platinum
• PubChem CID: 176606872
• Molecular Formula: C36H22N3O2Pt-
• Molecular Weight: 723.67 g/mol
• Exact Mass: 723.14
• IUPAC Name: 2-[[9-(4-phenyl-2-pyridinyl)-1H-carbazol-1-id-2-yl]oxy]benzo[g]quinolin-10-ol;platinum
• SMILES: Oc1c2ccccc2cc2ccc(Oc3[c-]c4c(cc3)c3ccccc3n4-c3cc(-c4ccccc4)ccn3)nc12.[Pt]
• InChI: InChI=1S/C36H22N3O2.Pt/c40-36-28-11-5-4-10-25(28)20-26-14-17-34(38-35(26)36)41-27-15-16-30-29-12-6-7-13-31(29)39(32(30)22-27)33-21-24(18-19-37-33)23-8-2-1-3-9-23;/h1-21,40H;/q-1
• InChIKey: MMFNJGNBJJWTPW-UHFFFAOYSA-N
• XLogP: 8.84
• TPSA: 60.17 Ų
• H-Bond Donors: 1
• H-Bond Acceptors: 5
• Rotatable Bonds: 4
• Heavy Atoms: 42
• Complexity: —

Lipinski Rule of Five

2 violations

Rule	Value
MW ≤ 500	723.67
LogP ≤ 5	8.84
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_2', 'substructure': 'N/A'}

Frequently Asked Questions

What is the IUPAC name of 2-[[9-(4-phenyl-2-pyridinyl)-1H-carbazol-1-id-2-yl]oxy]benzo[g]quinolin-10-ol;platinum?

The IUPAC name of 2-[[9-(4-phenyl-2-pyridinyl)-1H-carbazol-1-id-2-yl]oxy]benzo[g]quinolin-10-ol;platinum (CID 176606872) is 2-[[9-(4-phenyl-2-pyridinyl)-1H-carbazol-1-id-2-yl]oxy]benzo[g]quinolin-10-ol;platinum.

What is the SMILES notation for 2-[[9-(4-phenyl-2-pyridinyl)-1H-carbazol-1-id-2-yl]oxy]benzo[g]quinolin-10-ol;platinum?

The canonical SMILES for 2-[[9-(4-phenyl-2-pyridinyl)-1H-carbazol-1-id-2-yl]oxy]benzo[g]quinolin-10-ol;platinum is Oc1c2ccccc2cc2ccc(Oc3[c-]c4c(cc3)c3ccccc3n4-c3cc(-c4ccccc4)ccn3)nc12.[Pt].

What is the InChIKey of 2-[[9-(4-phenyl-2-pyridinyl)-1H-carbazol-1-id-2-yl]oxy]benzo[g]quinolin-10-ol;platinum?

The InChIKey is MMFNJGNBJJWTPW-UHFFFAOYSA-N. The full InChI is InChI=1S/C36H22N3O2.Pt/c40-36-28-11-5-4-10-25(28)20-26-14-17-34(38-35(26)36)41-27-15-16-30-29-12-6-7-13-31(29)39(32(30)22-27)33-21-24(18-19-37-33)23-8-2-1-3-9-23;/h1-21,40H;/q-1;.

What are the key properties of 2-[[9-(4-phenyl-2-pyridinyl)-1H-carbazol-1-id-2-yl]oxy]benzo[g]quinolin-10-ol;platinum?

2-[[9-(4-phenyl-2-pyridinyl)-1H-carbazol-1-id-2-yl]oxy]benzo[g]quinolin-10-ol;platinum has a molecular weight of 723.67 g/mol, XLogP of 8.84, 4 rotatable bonds, 1 hydrogen bond donors, and 5 hydrogen bond acceptors.

Where does this data come from?

All data for 2-[[9-(4-phenyl-2-pyridinyl)-1H-carbazol-1-id-2-yl]oxy]benzo[g]quinolin-10-ol;platinum is sourced from PubChem (CID 176606872), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).