2,4-difluoro-N-[5-[3-(3-hydroxyprop-1-ynyl)pyrazolo[1,5-a]pyridin-5-yl]-2-methoxy-3-pyridinyl]benzenesulfonamide;2,4-difluoro-N-[2-methoxy-5-[3-(2-piperidin-3-ylethynyl)pyrazolo[1,5-a]pyrimidin-5-yl]-3-pyridinyl]benzenesulfonamide;2,4-difluoro-N-[2-methoxy-5-(3-prop-1-ynylpyrazolo[1,5-a]pyridin-5-yl)-3-pyridinyl]benzenesulfonamide;N-[5-(3-ethynylpyrazolo[1,5-a]pyridin-5-yl)-2-methoxy-3-pyridinyl]-2,4-difluorobenzenesulfonamide

C90H68F8N18O13S4 — CID 159247480

About 2,4-difluoro-N-[5-[3-(3-hydroxyprop-1-ynyl)pyrazolo[1,5-a]pyridin-5-yl]-2-methoxy-3-pyridinyl]benzenesulfonamide;2,4-difluoro-N-[2-methoxy-5-[3-(2-piperidin-3-ylethynyl)pyrazolo[1,5-a]pyrimidin-5-yl]-3-pyridinyl]benzenesulfonamide;2,4-difluoro-N-[2-methoxy-5-(3-prop-1-ynylpyrazolo[1,5-a]pyridin-5-yl)-3-pyridinyl]benzenesulfonamide;N-[5-(3-ethynylpyrazolo[1,5-a]pyridin-5-yl)-2-methoxy-3-pyridinyl]-2,4-difluorobenzenesulfonamide

2,4-difluoro-N-[5-[3-(3-hydroxyprop-1-ynyl)pyrazolo[1,5-a]pyridin-5-yl]-2-methoxy-3-pyridinyl]benzenesulfonamide;2,4-difluoro-N-[2-methoxy-5-[3-(2-piperidin-3-ylethynyl)pyrazolo[1,5-a]pyrimidin-5-yl]-3-pyridinyl]benzenesulfonamide;2,4-difluoro-N-[2-methoxy-5-(3-prop-1-ynylpyrazolo[1,5-a]pyridin-5-yl)-3-pyridinyl]benzenesulfonamide;N-[5-(3-ethynylpyrazolo[1,5-a]pyridin-5-yl)-2-methoxy-3-pyridinyl]-2,4-difluorobenzenesulfonamide (PubChem CID 159247480) has the molecular formula C90H68F8N18O13S4 and a molecular weight of 1889.90 g/mol. Its IUPAC name is 2,4-difluoro-N-[5-[3-(3-hydroxyprop-1-ynyl)pyrazolo[1,5-a]pyridin-5-yl]-2-methoxy-3-pyridinyl]benzenesulfonamide;2,4-difluoro-N-[2-methoxy-5-[3-(2-piperidin-3-ylethynyl)pyrazolo[1,5-a]pyrimidin-5-yl]-3-pyridinyl]benzenesulfonamide;2,4-difluoro-N-[2-methoxy-5-(3-prop-1-ynylpyrazolo[1,5-a]pyridin-5-yl)-3-pyridinyl]benzenesulfonamide;N-[5-(3-ethynylpyrazolo[1,5-a]pyridin-5-yl)-2-methoxy-3-pyridinyl]-2,4-difluorobenzenesulfonamide.

Molecular Properties

• Compound Name: 2,4-difluoro-N-[5-[3-(3-hydroxyprop-1-ynyl)pyrazolo[1,5-a]pyridin-5-yl]-2-methoxy-3-pyridinyl]benzenesulfonamide;2,4-difluoro-N-[2-methoxy-5-[3-(2-piperidin-3-ylethynyl)pyrazolo[1,5-a]pyrimidin-5-yl]-3-pyridinyl]benzenesulfonamide;2,4-difluoro-N-[2-methoxy-5-(3-prop-1-ynylpyrazolo[1,5-a]pyridin-5-yl)-3-pyridinyl]benzenesulfonamide;N-[5-(3-ethynylpyrazolo[1,5-a]pyridin-5-yl)-2-methoxy-3-pyridinyl]-2,4-difluorobenzenesulfonamide
• PubChem CID: 159247480
• Molecular Formula: C90H68F8N18O13S4
• Molecular Weight: 1889.90 g/mol
• Exact Mass: 1888.40
• IUPAC Name: 2,4-difluoro-N-[5-[3-(3-hydroxyprop-1-ynyl)pyrazolo[1,5-a]pyridin-5-yl]-2-methoxy-3-pyridinyl]benzenesulfonamide;2,4-difluoro-N-[2-methoxy-5-[3-(2-piperidin-3-ylethynyl)pyrazolo[1,5-a]pyrimidin-5-yl]-3-pyridinyl]benzenesulfonamide;2,4-difluoro-N-[2-methoxy-5-(3-prop-1-ynylpyrazolo[1,5-a]pyridin-5-yl)-3-pyridinyl]benzenesulfonamide;N-[5-(3-ethynylpyrazolo[1,5-a]pyridin-5-yl)-2-methoxy-3-pyridinyl]-2,4-difluorobenzenesulfonamide
• SMILES: C#Cc1cnn2ccc(-c3cnc(OC)c(NS(=O)(=O)c4ccc(F)cc4F)c3)cc12.CC#Cc1cnn2ccc(-c3cnc(OC)c(NS(=O)(=O)c4ccc(F)cc4F)c3)cc12.COc1ncc(-c2ccn3ncc(C#CC4CCCNC4)c3n2)cc1NS(=O)(=O)c1ccc(F)cc1F.COc1ncc(-c2ccn3ncc(C#CCO)c3c2)cc1NS(=O)(=O)c1ccc(F)cc1F
• InChI: InChI=1S/C25H22F2N6O3S.C22H16F2N4O4S.C22H16F2N4O3S.C21H14F2N4O3S/c1-36-25-22(32-37(34,35)23-7-6-19(26)12-20(23)27)11-18(14-29-25)21-8-10-33-24(31-21)17(15-30-33)5-4-16-3-2-9-28-13-16;1-32-22-19(27-33(30,31)21-5-4-17(23)11-18(21)24)9-16(12-25-22)14-6-7-28-20(10-14)15(13-26-28)3-2-8-29;1-3-4-15-13-26-28-8-7-14(10-20(15)28)16-9-19(22(31-2)25-12-16)27-32(29,30)21-6-5-17(23)11-18(21)24;1-3-13-12-25-27-7-6-14(9-19(13)27)15-8-18(21(30-2)24-11-15)26-31(28,29)20-5-4-16(22)10-17(20)23/h6-8,10-12,14-16,28,32H,2-3,9,13H2,1H3;4-7,9-13,27,29H,8H2,1H3;5-13,27H,1-2H3;1,4-12,26H,2H3
• InChIKey: KUWCSEZPLSMBMK-UHFFFAOYSA-N
• XLogP: 13.38
• TPSA: 387.51 Ų
• H-Bond Donors: 6
• H-Bond Acceptors: 27
• Rotatable Bonds: 20
• Heavy Atoms: 133
• Complexity: —

Lipinski Rule of Five

4 violations

Rule	Value
MW ≤ 500	1889.90
LogP ≤ 5	13.38
H-Bond Donors ≤ 5	6
H-Bond Acceptors ≤ 10	27

Computed Properties (RDKit)

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

Frequently Asked Questions

What is the IUPAC name of 2,4-difluoro-N-[5-[3-(3-hydroxyprop-1-ynyl)pyrazolo[1,5-a]pyridin-5-yl]-2-methoxy-3-pyridinyl]benzenesulfonamide;2,4-difluoro-N-[2-methoxy-5-[3-(2-piperidin-3-ylethynyl)pyrazolo[1,5-a]pyrimidin-5-yl]-3-pyridinyl]benzenesulfonamide;2,4-difluoro-N-[2-methoxy-5-(3-prop-1-ynylpyrazolo[1,5-a]pyridin-5-yl)-3-pyridinyl]benzenesulfonamide;N-[5-(3-ethynylpyrazolo[1,5-a]pyridin-5-yl)-2-methoxy-3-pyridinyl]-2,4-difluorobenzenesulfonamide?

The IUPAC name of 2,4-difluoro-N-[5-[3-(3-hydroxyprop-1-ynyl)pyrazolo[1,5-a]pyridin-5-yl]-2-methoxy-3-pyridinyl]benzenesulfonamide;2,4-difluoro-N-[2-methoxy-5-[3-(2-piperidin-3-ylethynyl)pyrazolo[1,5-a]pyrimidin-5-yl]-3-pyridinyl]benzenesulfonamide;2,4-difluoro-N-[2-methoxy-5-(3-prop-1-ynylpyrazolo[1,5-a]pyridin-5-yl)-3-pyridinyl]benzenesulfonamide;N-[5-(3-ethynylpyrazolo[1,5-a]pyridin-5-yl)-2-methoxy-3-pyridinyl]-2,4-difluorobenzenesulfonamide (CID 159247480) is 2,4-difluoro-N-[5-[3-(3-hydroxyprop-1-ynyl)pyrazolo[1,5-a]pyridin-5-yl]-2-methoxy-3-pyridinyl]benzenesulfonamide;2,4-difluoro-N-[2-methoxy-5-[3-(2-piperidin-3-ylethynyl)pyrazolo[1,5-a]pyrimidin-5-yl]-3-pyridinyl]benzenesulfonamide;2,4-difluoro-N-[2-methoxy-5-(3-prop-1-ynylpyrazolo[1,5-a]pyridin-5-yl)-3-pyridinyl]benzenesulfonamide;N-[5-(3-ethynylpyrazolo[1,5-a]pyridin-5-yl)-2-methoxy-3-pyridinyl]-2,4-difluorobenzenesulfonamide.

What is the SMILES notation for 2,4-difluoro-N-[5-[3-(3-hydroxyprop-1-ynyl)pyrazolo[1,5-a]pyridin-5-yl]-2-methoxy-3-pyridinyl]benzenesulfonamide;2,4-difluoro-N-[2-methoxy-5-[3-(2-piperidin-3-ylethynyl)pyrazolo[1,5-a]pyrimidin-5-yl]-3-pyridinyl]benzenesulfonamide;2,4-difluoro-N-[2-methoxy-5-(3-prop-1-ynylpyrazolo[1,5-a]pyridin-5-yl)-3-pyridinyl]benzenesulfonamide;N-[5-(3-ethynylpyrazolo[1,5-a]pyridin-5-yl)-2-methoxy-3-pyridinyl]-2,4-difluorobenzenesulfonamide?

The canonical SMILES for 2,4-difluoro-N-[5-[3-(3-hydroxyprop-1-ynyl)pyrazolo[1,5-a]pyridin-5-yl]-2-methoxy-3-pyridinyl]benzenesulfonamide;2,4-difluoro-N-[2-methoxy-5-[3-(2-piperidin-3-ylethynyl)pyrazolo[1,5-a]pyrimidin-5-yl]-3-pyridinyl]benzenesulfonamide;2,4-difluoro-N-[2-methoxy-5-(3-prop-1-ynylpyrazolo[1,5-a]pyridin-5-yl)-3-pyridinyl]benzenesulfonamide;N-[5-(3-ethynylpyrazolo[1,5-a]pyridin-5-yl)-2-methoxy-3-pyridinyl]-2,4-difluorobenzenesulfonamide is C#Cc1cnn2ccc(-c3cnc(OC)c(NS(=O)(=O)c4ccc(F)cc4F)c3)cc12.CC#Cc1cnn2ccc(-c3cnc(OC)c(NS(=O)(=O)c4ccc(F)cc4F)c3)cc12.COc1ncc(-c2ccn3ncc(C#CC4CCCNC4)c3n2)cc1NS(=O)(=O)c1ccc(F)cc1F.COc1ncc(-c2ccn3ncc(C#CCO)c3c2)cc1NS(=O)(=O)c1ccc(F)cc1F.

What is the InChIKey of 2,4-difluoro-N-[5-[3-(3-hydroxyprop-1-ynyl)pyrazolo[1,5-a]pyridin-5-yl]-2-methoxy-3-pyridinyl]benzenesulfonamide;2,4-difluoro-N-[2-methoxy-5-[3-(2-piperidin-3-ylethynyl)pyrazolo[1,5-a]pyrimidin-5-yl]-3-pyridinyl]benzenesulfonamide;2,4-difluoro-N-[2-methoxy-5-(3-prop-1-ynylpyrazolo[1,5-a]pyridin-5-yl)-3-pyridinyl]benzenesulfonamide;N-[5-(3-ethynylpyrazolo[1,5-a]pyridin-5-yl)-2-methoxy-3-pyridinyl]-2,4-difluorobenzenesulfonamide?

The InChIKey is KUWCSEZPLSMBMK-UHFFFAOYSA-N. The full InChI is InChI=1S/C25H22F2N6O3S.C22H16F2N4O4S.C22H16F2N4O3S.C21H14F2N4O3S/c1-36-25-22(32-37(34,35)23-7-6-19(26)12-20(23)27)11-18(14-29-25)21-8-10-33-24(31-21)17(15-30-33)5-4-16-3-2-9-28-13-16;1-32-22-19(27-33(30,31)21-5-4-17(23)11-18(21)24)9-16(12-25-22)14-6-7-28-20(10-14)15(13-26-28)3-2-8-29;1-3-4-15-13-26-28-8-7-14(10-20(15)28)16-9-19(22(31-2)25-12-16)27-32(29,30)21-6-5-17(23)11-18(21)24;1-3-13-12-25-27-7-6-14(9-19(13)27)15-8-18(21(30-2)24-11-15)26-31(28,29)20-5-4-16(22)10-17(20)23/h6-8,10-12,14-16,28,32H,2-3,9,13H2,1H3;4-7,9-13,27,29H,8H2,1H3;5-13,27H,1-2H3;1,4-12,26H,2H3.

What are the key properties of 2,4-difluoro-N-[5-[3-(3-hydroxyprop-1-ynyl)pyrazolo[1,5-a]pyridin-5-yl]-2-methoxy-3-pyridinyl]benzenesulfonamide;2,4-difluoro-N-[2-methoxy-5-[3-(2-piperidin-3-ylethynyl)pyrazolo[1,5-a]pyrimidin-5-yl]-3-pyridinyl]benzenesulfonamide;2,4-difluoro-N-[2-methoxy-5-(3-prop-1-ynylpyrazolo[1,5-a]pyridin-5-yl)-3-pyridinyl]benzenesulfonamide;N-[5-(3-ethynylpyrazolo[1,5-a]pyridin-5-yl)-2-methoxy-3-pyridinyl]-2,4-difluorobenzenesulfonamide?

2,4-difluoro-N-[5-[3-(3-hydroxyprop-1-ynyl)pyrazolo[1,5-a]pyridin-5-yl]-2-methoxy-3-pyridinyl]benzenesulfonamide;2,4-difluoro-N-[2-methoxy-5-[3-(2-piperidin-3-ylethynyl)pyrazolo[1,5-a]pyrimidin-5-yl]-3-pyridinyl]benzenesulfonamide;2,4-difluoro-N-[2-methoxy-5-(3-prop-1-ynylpyrazolo[1,5-a]pyridin-5-yl)-3-pyridinyl]benzenesulfonamide;N-[5-(3-ethynylpyrazolo[1,5-a]pyridin-5-yl)-2-methoxy-3-pyridinyl]-2,4-difluorobenzenesulfonamide has a molecular weight of 1889.90 g/mol, XLogP of 13.38, 20 rotatable bonds, 6 hydrogen bond donors, and 27 hydrogen bond acceptors.

Where does this data come from?

All data for 2,4-difluoro-N-[5-[3-(3-hydroxyprop-1-ynyl)pyrazolo[1,5-a]pyridin-5-yl]-2-methoxy-3-pyridinyl]benzenesulfonamide;2,4-difluoro-N-[2-methoxy-5-[3-(2-piperidin-3-ylethynyl)pyrazolo[1,5-a]pyrimidin-5-yl]-3-pyridinyl]benzenesulfonamide;2,4-difluoro-N-[2-methoxy-5-(3-prop-1-ynylpyrazolo[1,5-a]pyridin-5-yl)-3-pyridinyl]benzenesulfonamide;N-[5-(3-ethynylpyrazolo[1,5-a]pyridin-5-yl)-2-methoxy-3-pyridinyl]-2,4-difluorobenzenesulfonamide is sourced from PubChem (CID 159247480), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).