[6-[2-[6-(2,6-difluoro-4H-pyridin-4-id-3-yl)-2-pyridinyl]propan-2-yl]pyridine-2-carbonyl]-(4-methylphenyl)sulfonylazanide;platinum(2+)

C26H20F2N4O3PtS — CID 59399293

About [6-[2-[6-(2,6-difluoro-4H-pyridin-4-id-3-yl)-2-pyridinyl]propan-2-yl]pyridine-2-carbonyl]-(4-methylphenyl)sulfonylazanide;platinum(2+)

[6-[2-[6-(2,6-difluoro-4H-pyridin-4-id-3-yl)-2-pyridinyl]propan-2-yl]pyridine-2-carbonyl]-(4-methylphenyl)sulfonylazanide;platinum(2+) (PubChem CID 59399293) has the molecular formula C26H20F2N4O3PtS and a molecular weight of 701.61 g/mol. Its IUPAC name is [6-[2-[6-(2,6-difluoro-4H-pyridin-4-id-3-yl)-2-pyridinyl]propan-2-yl]pyridine-2-carbonyl]-(4-methylphenyl)sulfonylazanide;platinum(2+).

Molecular Properties

• Compound Name: [6-[2-[6-(2,6-difluoro-4H-pyridin-4-id-3-yl)-2-pyridinyl]propan-2-yl]pyridine-2-carbonyl]-(4-methylphenyl)sulfonylazanide;platinum(2+)
• PubChem CID: 59399293
• Molecular Formula: C26H20F2N4O3PtS
• Molecular Weight: 701.61 g/mol
• Exact Mass: 701.09
• IUPAC Name: [6-[2-[6-(2,6-difluoro-4H-pyridin-4-id-3-yl)-2-pyridinyl]propan-2-yl]pyridine-2-carbonyl]-(4-methylphenyl)sulfonylazanide;platinum(2+)
• SMILES: Cc1ccc(S(=O)(=O)[N-]C(=O)c2cccc(C(C)(C)c3cccc(-c4[c-]cc(F)nc4F)n3)n2)cc1.[Pt+2]
• InChI: InChI=1S/C26H21F2N4O3S.Pt/c1-16-10-12-17(13-11-16)36(34,35)32-25(33)20-7-5-9-22(30-20)26(2,3)21-8-4-6-19(29-21)18-14-15-23(27)31-24(18)28;/h4-13,15H,1-3H3,(H,32,33);/q-1;+2/p-1
• InChIKey: FBJXUSOMFVEISB-UHFFFAOYSA-M
• XLogP: 5.15
• TPSA: 103.98 Ų
• H-Bond Acceptors: 6
• Rotatable Bonds: 6
• Heavy Atoms: 37
• Complexity: —

Lipinski Rule of Five

2 violations

Rule	Value
MW ≤ 500	701.61
LogP ≤ 5	5.15
H-Bond Donors ≤ 5	0
H-Bond Acceptors ≤ 10	6

Computed Properties (RDKit)

• Structural Alerts: {'alert_name': '2-halo_pyridine', 'substructure': 'N/A'}, {'alert_name': 'Carbo_cation/anion', 'substructure': 'N/A'}

Frequently Asked Questions

What is the IUPAC name of [6-[2-[6-(2,6-difluoro-4H-pyridin-4-id-3-yl)-2-pyridinyl]propan-2-yl]pyridine-2-carbonyl]-(4-methylphenyl)sulfonylazanide;platinum(2+)?

The IUPAC name of [6-[2-[6-(2,6-difluoro-4H-pyridin-4-id-3-yl)-2-pyridinyl]propan-2-yl]pyridine-2-carbonyl]-(4-methylphenyl)sulfonylazanide;platinum(2+) (CID 59399293) is [6-[2-[6-(2,6-difluoro-4H-pyridin-4-id-3-yl)-2-pyridinyl]propan-2-yl]pyridine-2-carbonyl]-(4-methylphenyl)sulfonylazanide;platinum(2+).

What is the SMILES notation for [6-[2-[6-(2,6-difluoro-4H-pyridin-4-id-3-yl)-2-pyridinyl]propan-2-yl]pyridine-2-carbonyl]-(4-methylphenyl)sulfonylazanide;platinum(2+)?

The canonical SMILES for [6-[2-[6-(2,6-difluoro-4H-pyridin-4-id-3-yl)-2-pyridinyl]propan-2-yl]pyridine-2-carbonyl]-(4-methylphenyl)sulfonylazanide;platinum(2+) is Cc1ccc(S(=O)(=O)[N-]C(=O)c2cccc(C(C)(C)c3cccc(-c4[c-]cc(F)nc4F)n3)n2)cc1.[Pt+2].

What is the InChIKey of [6-[2-[6-(2,6-difluoro-4H-pyridin-4-id-3-yl)-2-pyridinyl]propan-2-yl]pyridine-2-carbonyl]-(4-methylphenyl)sulfonylazanide;platinum(2+)?

The InChIKey is FBJXUSOMFVEISB-UHFFFAOYSA-M. The full InChI is InChI=1S/C26H21F2N4O3S.Pt/c1-16-10-12-17(13-11-16)36(34,35)32-25(33)20-7-5-9-22(30-20)26(2,3)21-8-4-6-19(29-21)18-14-15-23(27)31-24(18)28;/h4-13,15H,1-3H3,(H,32,33);/q-1;+2/p-1.

What are the key properties of [6-[2-[6-(2,6-difluoro-4H-pyridin-4-id-3-yl)-2-pyridinyl]propan-2-yl]pyridine-2-carbonyl]-(4-methylphenyl)sulfonylazanide;platinum(2+)?

[6-[2-[6-(2,6-difluoro-4H-pyridin-4-id-3-yl)-2-pyridinyl]propan-2-yl]pyridine-2-carbonyl]-(4-methylphenyl)sulfonylazanide;platinum(2+) has a molecular weight of 701.61 g/mol, XLogP of 5.15, 6 rotatable bonds, 0 hydrogen bond donors, and 6 hydrogen bond acceptors.

Where does this data come from?

All data for [6-[2-[6-(2,6-difluoro-4H-pyridin-4-id-3-yl)-2-pyridinyl]propan-2-yl]pyridine-2-carbonyl]-(4-methylphenyl)sulfonylazanide;platinum(2+) is sourced from PubChem (CID 59399293), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).