sodium;6-[(6-fluoro-2-pyridinyl)sulfonylmethyl]-2-(2-methylphenyl)-3-(trifluoromethyl)pyridine;hydride;6-[(3R,4S)-4-hydroxyoxolan-3-yl]oxy-N-[6-(2-methylphenyl)-5-(trifluoromethyl)-2-pyridinyl]pyridine-2-sulfonamide;6-[(3S,4R)-4-hydroxyoxolan-3-yl]oxy-N-[6-(2-methylphenyl)-5-(trifluoromethyl)-2-pyridinyl]pyridine-2-sulfonamide;(3R,4S)-oxolane-3,4-diol

C67H63F10N8NaO15S3 — CID 158689325

About sodium;6-[(6-fluoro-2-pyridinyl)sulfonylmethyl]-2-(2-methylphenyl)-3-(trifluoromethyl)pyridine;hydride;6-[(3R,4S)-4-hydroxyoxolan-3-yl]oxy-N-[6-(2-methylphenyl)-5-(trifluoromethyl)-2-pyridinyl]pyridine-2-sulfonamide;6-[(3S,4R)-4-hydroxyoxolan-3-yl]oxy-N-[6-(2-methylphenyl)-5-(trifluoromethyl)-2-pyridinyl]pyridine-2-sulfonamide;(3R,4S)-oxolane-3,4-diol

sodium;6-[(6-fluoro-2-pyridinyl)sulfonylmethyl]-2-(2-methylphenyl)-3-(trifluoromethyl)pyridine;hydride;6-[(3R,4S)-4-hydroxyoxolan-3-yl]oxy-N-[6-(2-methylphenyl)-5-(trifluoromethyl)-2-pyridinyl]pyridine-2-sulfonamide;6-[(3S,4R)-4-hydroxyoxolan-3-yl]oxy-N-[6-(2-methylphenyl)-5-(trifluoromethyl)-2-pyridinyl]pyridine-2-sulfonamide;(3R,4S)-oxolane-3,4-diol (PubChem CID 158689325) has the molecular formula C67H63F10N8NaO15S3 and a molecular weight of 1529.45 g/mol. Its IUPAC name is sodium;6-[(6-fluoro-2-pyridinyl)sulfonylmethyl]-2-(2-methylphenyl)-3-(trifluoromethyl)pyridine;hydride;6-[(3R,4S)-4-hydroxyoxolan-3-yl]oxy-N-[6-(2-methylphenyl)-5-(trifluoromethyl)-2-pyridinyl]pyridine-2-sulfonamide;6-[(3S,4R)-4-hydroxyoxolan-3-yl]oxy-N-[6-(2-methylphenyl)-5-(trifluoromethyl)-2-pyridinyl]pyridine-2-sulfonamide;(3R,4S)-oxolane-3,4-diol.

Molecular Properties

• Compound Name: sodium;6-[(6-fluoro-2-pyridinyl)sulfonylmethyl]-2-(2-methylphenyl)-3-(trifluoromethyl)pyridine;hydride;6-[(3R,4S)-4-hydroxyoxolan-3-yl]oxy-N-[6-(2-methylphenyl)-5-(trifluoromethyl)-2-pyridinyl]pyridine-2-sulfonamide;6-[(3S,4R)-4-hydroxyoxolan-3-yl]oxy-N-[6-(2-methylphenyl)-5-(trifluoromethyl)-2-pyridinyl]pyridine-2-sulfonamide;(3R,4S)-oxolane-3,4-diol
• PubChem CID: 158689325
• Molecular Formula: C67H63F10N8NaO15S3
• Molecular Weight: 1529.45 g/mol
• Exact Mass: 1528.33
• IUPAC Name: sodium;6-[(6-fluoro-2-pyridinyl)sulfonylmethyl]-2-(2-methylphenyl)-3-(trifluoromethyl)pyridine;hydride;6-[(3R,4S)-4-hydroxyoxolan-3-yl]oxy-N-[6-(2-methylphenyl)-5-(trifluoromethyl)-2-pyridinyl]pyridine-2-sulfonamide;6-[(3S,4R)-4-hydroxyoxolan-3-yl]oxy-N-[6-(2-methylphenyl)-5-(trifluoromethyl)-2-pyridinyl]pyridine-2-sulfonamide;(3R,4S)-oxolane-3,4-diol
• SMILES: Cc1ccccc1-c1nc(CS(=O)(=O)c2cccc(F)n2)ccc1C(F)(F)F.Cc1ccccc1-c1nc(NS(=O)(=O)c2cccc(O[C@@H]3COC[C@@H]3O)n2)ccc1C(F)(F)F.Cc1ccccc1-c1nc(NS(=O)(=O)c2cccc(O[C@H]3COC[C@H]3O)n2)ccc1C(F)(F)F.O[C@@H]1COC[C@@H]1O.[H-].[Na+]
• InChI: InChI=1S/2C22H20F3N3O5S.C19H14F4N2O2S.C4H8O3.Na.H/c2*1-13-5-2-3-6-14(13)21-15(22(23,24)25)9-10-18(26-21)28-34(30,31)20-8-4-7-19(27-20)33-17-12-32-11-16(17)29;1-12-5-2-3-6-14(12)18-15(19(21,22)23)10-9-13(24-18)11-28(26,27)17-8-4-7-16(20)25-17;5-3-1-7-2-4(3)6;;/h2*2-10,16-17,29H,11-12H2,1H3,(H,26,28);2-10H,11H2,1H3;3-6H,1-2H2;;/q;;;;+1;-1/t2*16-,17+;;3-,4+;;/m10..../s1
• InChIKey: DIZVMSFKMZVPJZ-QDWNEUIGSA-N
• XLogP: 7.26
• TPSA: 330.89 Ų
• H-Bond Donors: 6
• H-Bond Acceptors: 21
• Rotatable Bonds: 16
• Heavy Atoms: 104
• Complexity: —

Lipinski Rule of Five

4 violations

Rule	Value
MW ≤ 500	1529.45
LogP ≤ 5	7.26
H-Bond Donors ≤ 5	6
H-Bond Acceptors ≤ 10	21

Computed Properties (RDKit)

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

Frequently Asked Questions

What is the IUPAC name of sodium;6-[(6-fluoro-2-pyridinyl)sulfonylmethyl]-2-(2-methylphenyl)-3-(trifluoromethyl)pyridine;hydride;6-[(3R,4S)-4-hydroxyoxolan-3-yl]oxy-N-[6-(2-methylphenyl)-5-(trifluoromethyl)-2-pyridinyl]pyridine-2-sulfonamide;6-[(3S,4R)-4-hydroxyoxolan-3-yl]oxy-N-[6-(2-methylphenyl)-5-(trifluoromethyl)-2-pyridinyl]pyridine-2-sulfonamide;(3R,4S)-oxolane-3,4-diol?

The IUPAC name of sodium;6-[(6-fluoro-2-pyridinyl)sulfonylmethyl]-2-(2-methylphenyl)-3-(trifluoromethyl)pyridine;hydride;6-[(3R,4S)-4-hydroxyoxolan-3-yl]oxy-N-[6-(2-methylphenyl)-5-(trifluoromethyl)-2-pyridinyl]pyridine-2-sulfonamide;6-[(3S,4R)-4-hydroxyoxolan-3-yl]oxy-N-[6-(2-methylphenyl)-5-(trifluoromethyl)-2-pyridinyl]pyridine-2-sulfonamide;(3R,4S)-oxolane-3,4-diol (CID 158689325) is sodium;6-[(6-fluoro-2-pyridinyl)sulfonylmethyl]-2-(2-methylphenyl)-3-(trifluoromethyl)pyridine;hydride;6-[(3R,4S)-4-hydroxyoxolan-3-yl]oxy-N-[6-(2-methylphenyl)-5-(trifluoromethyl)-2-pyridinyl]pyridine-2-sulfonamide;6-[(3S,4R)-4-hydroxyoxolan-3-yl]oxy-N-[6-(2-methylphenyl)-5-(trifluoromethyl)-2-pyridinyl]pyridine-2-sulfonamide;(3R,4S)-oxolane-3,4-diol.

What is the SMILES notation for sodium;6-[(6-fluoro-2-pyridinyl)sulfonylmethyl]-2-(2-methylphenyl)-3-(trifluoromethyl)pyridine;hydride;6-[(3R,4S)-4-hydroxyoxolan-3-yl]oxy-N-[6-(2-methylphenyl)-5-(trifluoromethyl)-2-pyridinyl]pyridine-2-sulfonamide;6-[(3S,4R)-4-hydroxyoxolan-3-yl]oxy-N-[6-(2-methylphenyl)-5-(trifluoromethyl)-2-pyridinyl]pyridine-2-sulfonamide;(3R,4S)-oxolane-3,4-diol?

The canonical SMILES for sodium;6-[(6-fluoro-2-pyridinyl)sulfonylmethyl]-2-(2-methylphenyl)-3-(trifluoromethyl)pyridine;hydride;6-[(3R,4S)-4-hydroxyoxolan-3-yl]oxy-N-[6-(2-methylphenyl)-5-(trifluoromethyl)-2-pyridinyl]pyridine-2-sulfonamide;6-[(3S,4R)-4-hydroxyoxolan-3-yl]oxy-N-[6-(2-methylphenyl)-5-(trifluoromethyl)-2-pyridinyl]pyridine-2-sulfonamide;(3R,4S)-oxolane-3,4-diol is Cc1ccccc1-c1nc(CS(=O)(=O)c2cccc(F)n2)ccc1C(F)(F)F.Cc1ccccc1-c1nc(NS(=O)(=O)c2cccc(O[C@@H]3COC[C@@H]3O)n2)ccc1C(F)(F)F.Cc1ccccc1-c1nc(NS(=O)(=O)c2cccc(O[C@H]3COC[C@H]3O)n2)ccc1C(F)(F)F.O[C@@H]1COC[C@@H]1O.[H-].[Na+].

What is the InChIKey of sodium;6-[(6-fluoro-2-pyridinyl)sulfonylmethyl]-2-(2-methylphenyl)-3-(trifluoromethyl)pyridine;hydride;6-[(3R,4S)-4-hydroxyoxolan-3-yl]oxy-N-[6-(2-methylphenyl)-5-(trifluoromethyl)-2-pyridinyl]pyridine-2-sulfonamide;6-[(3S,4R)-4-hydroxyoxolan-3-yl]oxy-N-[6-(2-methylphenyl)-5-(trifluoromethyl)-2-pyridinyl]pyridine-2-sulfonamide;(3R,4S)-oxolane-3,4-diol?

The InChIKey is DIZVMSFKMZVPJZ-QDWNEUIGSA-N. The full InChI is InChI=1S/2C22H20F3N3O5S.C19H14F4N2O2S.C4H8O3.Na.H/c2*1-13-5-2-3-6-14(13)21-15(22(23,24)25)9-10-18(26-21)28-34(30,31)20-8-4-7-19(27-20)33-17-12-32-11-16(17)29;1-12-5-2-3-6-14(12)18-15(19(21,22)23)10-9-13(24-18)11-28(26,27)17-8-4-7-16(20)25-17;5-3-1-7-2-4(3)6;;/h2*2-10,16-17,29H,11-12H2,1H3,(H,26,28);2-10H,11H2,1H3;3-6H,1-2H2;;/q;;;;+1;-1/t2*16-,17+;;3-,4+;;/m10..../s1.

What are the key properties of sodium;6-[(6-fluoro-2-pyridinyl)sulfonylmethyl]-2-(2-methylphenyl)-3-(trifluoromethyl)pyridine;hydride;6-[(3R,4S)-4-hydroxyoxolan-3-yl]oxy-N-[6-(2-methylphenyl)-5-(trifluoromethyl)-2-pyridinyl]pyridine-2-sulfonamide;6-[(3S,4R)-4-hydroxyoxolan-3-yl]oxy-N-[6-(2-methylphenyl)-5-(trifluoromethyl)-2-pyridinyl]pyridine-2-sulfonamide;(3R,4S)-oxolane-3,4-diol?

sodium;6-[(6-fluoro-2-pyridinyl)sulfonylmethyl]-2-(2-methylphenyl)-3-(trifluoromethyl)pyridine;hydride;6-[(3R,4S)-4-hydroxyoxolan-3-yl]oxy-N-[6-(2-methylphenyl)-5-(trifluoromethyl)-2-pyridinyl]pyridine-2-sulfonamide;6-[(3S,4R)-4-hydroxyoxolan-3-yl]oxy-N-[6-(2-methylphenyl)-5-(trifluoromethyl)-2-pyridinyl]pyridine-2-sulfonamide;(3R,4S)-oxolane-3,4-diol has a molecular weight of 1529.45 g/mol, XLogP of 7.26, 16 rotatable bonds, 6 hydrogen bond donors, and 21 hydrogen bond acceptors.

Where does this data come from?

All data for sodium;6-[(6-fluoro-2-pyridinyl)sulfonylmethyl]-2-(2-methylphenyl)-3-(trifluoromethyl)pyridine;hydride;6-[(3R,4S)-4-hydroxyoxolan-3-yl]oxy-N-[6-(2-methylphenyl)-5-(trifluoromethyl)-2-pyridinyl]pyridine-2-sulfonamide;6-[(3S,4R)-4-hydroxyoxolan-3-yl]oxy-N-[6-(2-methylphenyl)-5-(trifluoromethyl)-2-pyridinyl]pyridine-2-sulfonamide;(3R,4S)-oxolane-3,4-diol is sourced from PubChem (CID 158689325), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).