2-(2,4-difluorobenzene-6-id-1-yl)-6-[2-[6-(2,4-difluorobenzene-6-id-1-yl)oxy-2-pyridinyl]propan-2-yl]pyridine;platinum(2+)

C25H16F4N2OPt — CID 59646062

About 2-(2,4-difluorobenzene-6-id-1-yl)-6-[2-[6-(2,4-difluorobenzene-6-id-1-yl)oxy-2-pyridinyl]propan-2-yl]pyridine;platinum(2+)

2-(2,4-difluorobenzene-6-id-1-yl)-6-[2-[6-(2,4-difluorobenzene-6-id-1-yl)oxy-2-pyridinyl]propan-2-yl]pyridine;platinum(2+) (PubChem CID 59646062) has the molecular formula C25H16F4N2OPt and a molecular weight of 631.49 g/mol. Its IUPAC name is 2-(2,4-difluorobenzene-6-id-1-yl)-6-[2-[6-(2,4-difluorobenzene-6-id-1-yl)oxy-2-pyridinyl]propan-2-yl]pyridine;platinum(2+).

Molecular Properties

• Compound Name: 2-(2,4-difluorobenzene-6-id-1-yl)-6-[2-[6-(2,4-difluorobenzene-6-id-1-yl)oxy-2-pyridinyl]propan-2-yl]pyridine;platinum(2+)
• PubChem CID: 59646062
• Molecular Formula: C25H16F4N2OPt
• Molecular Weight: 631.49 g/mol
• Exact Mass: 631.08
• IUPAC Name: 2-(2,4-difluorobenzene-6-id-1-yl)-6-[2-[6-(2,4-difluorobenzene-6-id-1-yl)oxy-2-pyridinyl]propan-2-yl]pyridine;platinum(2+)
• SMILES: CC(C)(c1cccc(Oc2[c-]cc(F)cc2F)n1)c1cccc(-c2[c-]cc(F)cc2F)n1.[Pt+2]
• InChI: InChI=1S/C25H16F4N2O.Pt/c1-25(2,22-6-3-5-20(30-22)17-11-9-15(26)13-18(17)28)23-7-4-8-24(31-23)32-21-12-10-16(27)14-19(21)29;/h3-10,13-14H,1-2H3;/q-2;+2
• InChIKey: UNTKQFBOPROTJY-UHFFFAOYSA-N
• XLogP: 6.42
• TPSA: 35.01 Ų
• H-Bond Acceptors: 3
• Rotatable Bonds: 5
• Heavy Atoms: 33
• Complexity: —

Lipinski Rule of Five

2 violations

Rule	Value
MW ≤ 500	631.49
LogP ≤ 5	6.42
H-Bond Donors ≤ 5	0
H-Bond Acceptors ≤ 10	3

Computed Properties (RDKit)

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

Frequently Asked Questions

What is the IUPAC name of 2-(2,4-difluorobenzene-6-id-1-yl)-6-[2-[6-(2,4-difluorobenzene-6-id-1-yl)oxy-2-pyridinyl]propan-2-yl]pyridine;platinum(2+)?

The IUPAC name of 2-(2,4-difluorobenzene-6-id-1-yl)-6-[2-[6-(2,4-difluorobenzene-6-id-1-yl)oxy-2-pyridinyl]propan-2-yl]pyridine;platinum(2+) (CID 59646062) is 2-(2,4-difluorobenzene-6-id-1-yl)-6-[2-[6-(2,4-difluorobenzene-6-id-1-yl)oxy-2-pyridinyl]propan-2-yl]pyridine;platinum(2+).

What is the SMILES notation for 2-(2,4-difluorobenzene-6-id-1-yl)-6-[2-[6-(2,4-difluorobenzene-6-id-1-yl)oxy-2-pyridinyl]propan-2-yl]pyridine;platinum(2+)?

The canonical SMILES for 2-(2,4-difluorobenzene-6-id-1-yl)-6-[2-[6-(2,4-difluorobenzene-6-id-1-yl)oxy-2-pyridinyl]propan-2-yl]pyridine;platinum(2+) is CC(C)(c1cccc(Oc2[c-]cc(F)cc2F)n1)c1cccc(-c2[c-]cc(F)cc2F)n1.[Pt+2].

What is the InChIKey of 2-(2,4-difluorobenzene-6-id-1-yl)-6-[2-[6-(2,4-difluorobenzene-6-id-1-yl)oxy-2-pyridinyl]propan-2-yl]pyridine;platinum(2+)?

The InChIKey is UNTKQFBOPROTJY-UHFFFAOYSA-N. The full InChI is InChI=1S/C25H16F4N2O.Pt/c1-25(2,22-6-3-5-20(30-22)17-11-9-15(26)13-18(17)28)23-7-4-8-24(31-23)32-21-12-10-16(27)14-19(21)29;/h3-10,13-14H,1-2H3;/q-2;+2.

What are the key properties of 2-(2,4-difluorobenzene-6-id-1-yl)-6-[2-[6-(2,4-difluorobenzene-6-id-1-yl)oxy-2-pyridinyl]propan-2-yl]pyridine;platinum(2+)?

2-(2,4-difluorobenzene-6-id-1-yl)-6-[2-[6-(2,4-difluorobenzene-6-id-1-yl)oxy-2-pyridinyl]propan-2-yl]pyridine;platinum(2+) has a molecular weight of 631.49 g/mol, XLogP of 6.42, 5 rotatable bonds, 0 hydrogen bond donors, and 3 hydrogen bond acceptors.

Where does this data come from?

All data for 2-(2,4-difluorobenzene-6-id-1-yl)-6-[2-[6-(2,4-difluorobenzene-6-id-1-yl)oxy-2-pyridinyl]propan-2-yl]pyridine;platinum(2+) is sourced from PubChem (CID 59646062), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).