7-ethyl-2-[(4-methyl-9-pyridin-2-yl-1H-carbazol-1-id-2-yl)oxy]quinolin-8-ol;platinum

C29H22N3O2Pt- — CID 176606621

About 7-ethyl-2-[(4-methyl-9-pyridin-2-yl-1H-carbazol-1-id-2-yl)oxy]quinolin-8-ol;platinum

7-ethyl-2-[(4-methyl-9-pyridin-2-yl-1H-carbazol-1-id-2-yl)oxy]quinolin-8-ol;platinum (PubChem CID 176606621) has the molecular formula C29H22N3O2Pt- and a molecular weight of 639.59 g/mol. Its IUPAC name is 7-ethyl-2-[(4-methyl-9-pyridin-2-yl-1H-carbazol-1-id-2-yl)oxy]quinolin-8-ol;platinum.

Molecular Properties

• Compound Name: 7-ethyl-2-[(4-methyl-9-pyridin-2-yl-1H-carbazol-1-id-2-yl)oxy]quinolin-8-ol;platinum
• PubChem CID: 176606621
• Molecular Formula: C29H22N3O2Pt-
• Molecular Weight: 639.59 g/mol
• Exact Mass: 639.14
• IUPAC Name: 7-ethyl-2-[(4-methyl-9-pyridin-2-yl-1H-carbazol-1-id-2-yl)oxy]quinolin-8-ol;platinum
• SMILES: CCc1ccc2ccc(Oc3[c-]c4c(c(C)c3)c3ccccc3n4-c3ccccn3)nc2c1O.[Pt]
• InChI: InChI=1S/C29H22N3O2.Pt/c1-3-19-11-12-20-13-14-26(31-28(20)29(19)33)34-21-16-18(2)27-22-8-4-5-9-23(22)32(24(27)17-21)25-10-6-7-15-30-25;/h4-16,33H,3H2,1-2H3;/q-1
• InChIKey: FJLOHJOSQRAKOJ-UHFFFAOYSA-N
• XLogP: 6.89
• TPSA: 60.17 Ų
• H-Bond Donors: 1
• H-Bond Acceptors: 5
• Rotatable Bonds: 4
• Heavy Atoms: 35
• Complexity: —

Lipinski Rule of Five

2 violations

Rule	Value
MW ≤ 500	639.59
LogP ≤ 5	6.89
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 7-ethyl-2-[(4-methyl-9-pyridin-2-yl-1H-carbazol-1-id-2-yl)oxy]quinolin-8-ol;platinum?

The IUPAC name of 7-ethyl-2-[(4-methyl-9-pyridin-2-yl-1H-carbazol-1-id-2-yl)oxy]quinolin-8-ol;platinum (CID 176606621) is 7-ethyl-2-[(4-methyl-9-pyridin-2-yl-1H-carbazol-1-id-2-yl)oxy]quinolin-8-ol;platinum.

What is the SMILES notation for 7-ethyl-2-[(4-methyl-9-pyridin-2-yl-1H-carbazol-1-id-2-yl)oxy]quinolin-8-ol;platinum?

The canonical SMILES for 7-ethyl-2-[(4-methyl-9-pyridin-2-yl-1H-carbazol-1-id-2-yl)oxy]quinolin-8-ol;platinum is CCc1ccc2ccc(Oc3[c-]c4c(c(C)c3)c3ccccc3n4-c3ccccn3)nc2c1O.[Pt].

What is the InChIKey of 7-ethyl-2-[(4-methyl-9-pyridin-2-yl-1H-carbazol-1-id-2-yl)oxy]quinolin-8-ol;platinum?

The InChIKey is FJLOHJOSQRAKOJ-UHFFFAOYSA-N. The full InChI is InChI=1S/C29H22N3O2.Pt/c1-3-19-11-12-20-13-14-26(31-28(20)29(19)33)34-21-16-18(2)27-22-8-4-5-9-23(22)32(24(27)17-21)25-10-6-7-15-30-25;/h4-16,33H,3H2,1-2H3;/q-1;.

What are the key properties of 7-ethyl-2-[(4-methyl-9-pyridin-2-yl-1H-carbazol-1-id-2-yl)oxy]quinolin-8-ol;platinum?

7-ethyl-2-[(4-methyl-9-pyridin-2-yl-1H-carbazol-1-id-2-yl)oxy]quinolin-8-ol;platinum has a molecular weight of 639.59 g/mol, XLogP of 6.89, 4 rotatable bonds, 1 hydrogen bond donors, and 5 hydrogen bond acceptors.

Where does this data come from?

All data for 7-ethyl-2-[(4-methyl-9-pyridin-2-yl-1H-carbazol-1-id-2-yl)oxy]quinolin-8-ol;platinum is sourced from PubChem (CID 176606621), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).