2-[[6-tert-butyl-9-(6-ethyl-2-pyridinyl)-1H-carbazol-1-id-2-yl]oxy]quinolin-8-ol;platinum

C32H28N3O2Pt- — CID 176605807

About 2-[[6-tert-butyl-9-(6-ethyl-2-pyridinyl)-1H-carbazol-1-id-2-yl]oxy]quinolin-8-ol;platinum

2-[[6-tert-butyl-9-(6-ethyl-2-pyridinyl)-1H-carbazol-1-id-2-yl]oxy]quinolin-8-ol;platinum (PubChem CID 176605807) has the molecular formula C32H28N3O2Pt- and a molecular weight of 681.67 g/mol. Its IUPAC name is 2-[[6-tert-butyl-9-(6-ethyl-2-pyridinyl)-1H-carbazol-1-id-2-yl]oxy]quinolin-8-ol;platinum.

Molecular Properties

• Compound Name: 2-[[6-tert-butyl-9-(6-ethyl-2-pyridinyl)-1H-carbazol-1-id-2-yl]oxy]quinolin-8-ol;platinum
• PubChem CID: 176605807
• Molecular Formula: C32H28N3O2Pt-
• Molecular Weight: 681.67 g/mol
• Exact Mass: 681.18
• IUPAC Name: 2-[[6-tert-butyl-9-(6-ethyl-2-pyridinyl)-1H-carbazol-1-id-2-yl]oxy]quinolin-8-ol;platinum
• SMILES: CCc1cccc(-n2c3[c-]c(Oc4ccc5cccc(O)c5n4)ccc3c3cc(C(C)(C)C)ccc32)n1.[Pt]
• InChI: InChI=1S/C32H28N3O2.Pt/c1-5-22-9-7-11-29(33-22)35-26-16-13-21(32(2,3)4)18-25(26)24-15-14-23(19-27(24)35)37-30-17-12-20-8-6-10-28(36)31(20)34-30;/h6-18,36H,5H2,1-4H3;/q-1
• InChIKey: IZIVRVLGWNCKLC-UHFFFAOYSA-N
• XLogP: 7.88
• TPSA: 60.17 Ų
• H-Bond Donors: 1
• H-Bond Acceptors: 5
• Rotatable Bonds: 4
• Heavy Atoms: 38
• Complexity: —

Lipinski Rule of Five

2 violations

Rule	Value
MW ≤ 500	681.67
LogP ≤ 5	7.88
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-[[6-tert-butyl-9-(6-ethyl-2-pyridinyl)-1H-carbazol-1-id-2-yl]oxy]quinolin-8-ol;platinum?

The IUPAC name of 2-[[6-tert-butyl-9-(6-ethyl-2-pyridinyl)-1H-carbazol-1-id-2-yl]oxy]quinolin-8-ol;platinum (CID 176605807) is 2-[[6-tert-butyl-9-(6-ethyl-2-pyridinyl)-1H-carbazol-1-id-2-yl]oxy]quinolin-8-ol;platinum.

What is the SMILES notation for 2-[[6-tert-butyl-9-(6-ethyl-2-pyridinyl)-1H-carbazol-1-id-2-yl]oxy]quinolin-8-ol;platinum?

The canonical SMILES for 2-[[6-tert-butyl-9-(6-ethyl-2-pyridinyl)-1H-carbazol-1-id-2-yl]oxy]quinolin-8-ol;platinum is CCc1cccc(-n2c3[c-]c(Oc4ccc5cccc(O)c5n4)ccc3c3cc(C(C)(C)C)ccc32)n1.[Pt].

What is the InChIKey of 2-[[6-tert-butyl-9-(6-ethyl-2-pyridinyl)-1H-carbazol-1-id-2-yl]oxy]quinolin-8-ol;platinum?

The InChIKey is IZIVRVLGWNCKLC-UHFFFAOYSA-N. The full InChI is InChI=1S/C32H28N3O2.Pt/c1-5-22-9-7-11-29(33-22)35-26-16-13-21(32(2,3)4)18-25(26)24-15-14-23(19-27(24)35)37-30-17-12-20-8-6-10-28(36)31(20)34-30;/h6-18,36H,5H2,1-4H3;/q-1;.

What are the key properties of 2-[[6-tert-butyl-9-(6-ethyl-2-pyridinyl)-1H-carbazol-1-id-2-yl]oxy]quinolin-8-ol;platinum?

2-[[6-tert-butyl-9-(6-ethyl-2-pyridinyl)-1H-carbazol-1-id-2-yl]oxy]quinolin-8-ol;platinum has a molecular weight of 681.67 g/mol, XLogP of 7.88, 4 rotatable bonds, 1 hydrogen bond donors, and 5 hydrogen bond acceptors.

Where does this data come from?

All data for 2-[[6-tert-butyl-9-(6-ethyl-2-pyridinyl)-1H-carbazol-1-id-2-yl]oxy]quinolin-8-ol;platinum is sourced from PubChem (CID 176605807), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).