dipotassium;2-chloro-1-[4-(4-chloro-2-fluoro-5-methylphenyl)piperazin-1-yl]ethanone;1-[4-(4-chloro-2-fluoro-5-methylphenyl)piperazin-1-yl]-2-pyrazolo[3,4-b]pyridin-2-ylethanone;1-[4-(4-chloro-2-fluoro-5-methylphenyl)piperazin-1-yl]-2-pyrazolo[5,4-b]pyridin-1-ylethanone;hydride;oxido formate;1H-pyrazolo[5,4-b]pyridine

C58H60Cl4F3K2N15O6 — CID 157085015

About dipotassium;2-chloro-1-[4-(4-chloro-2-fluoro-5-methylphenyl)piperazin-1-yl]ethanone;1-[4-(4-chloro-2-fluoro-5-methylphenyl)piperazin-1-yl]-2-pyrazolo[3,4-b]pyridin-2-ylethanone;1-[4-(4-chloro-2-fluoro-5-methylphenyl)piperazin-1-yl]-2-pyrazolo[5,4-b]pyridin-1-ylethanone;hydride;oxido formate;1H-pyrazolo[5,4-b]pyridine

dipotassium;2-chloro-1-[4-(4-chloro-2-fluoro-5-methylphenyl)piperazin-1-yl]ethanone;1-[4-(4-chloro-2-fluoro-5-methylphenyl)piperazin-1-yl]-2-pyrazolo[3,4-b]pyridin-2-ylethanone;1-[4-(4-chloro-2-fluoro-5-methylphenyl)piperazin-1-yl]-2-pyrazolo[5,4-b]pyridin-1-ylethanone;hydride;oxido formate;1H-pyrazolo[5,4-b]pyridine (PubChem CID 157085015) has the molecular formula C58H60Cl4F3K2N15O6 and a molecular weight of 1340.22 g/mol. Its IUPAC name is dipotassium;2-chloro-1-[4-(4-chloro-2-fluoro-5-methylphenyl)piperazin-1-yl]ethanone;1-[4-(4-chloro-2-fluoro-5-methylphenyl)piperazin-1-yl]-2-pyrazolo[3,4-b]pyridin-2-ylethanone;1-[4-(4-chloro-2-fluoro-5-methylphenyl)piperazin-1-yl]-2-pyrazolo[5,4-b]pyridin-1-ylethanone;hydride;oxido formate;1H-pyrazolo[5,4-b]pyridine.

Molecular Properties

• Compound Name: dipotassium;2-chloro-1-[4-(4-chloro-2-fluoro-5-methylphenyl)piperazin-1-yl]ethanone;1-[4-(4-chloro-2-fluoro-5-methylphenyl)piperazin-1-yl]-2-pyrazolo[3,4-b]pyridin-2-ylethanone;1-[4-(4-chloro-2-fluoro-5-methylphenyl)piperazin-1-yl]-2-pyrazolo[5,4-b]pyridin-1-ylethanone;hydride;oxido formate;1H-pyrazolo[5,4-b]pyridine
• PubChem CID: 157085015
• Molecular Formula: C58H60Cl4F3K2N15O6
• Molecular Weight: 1340.22 g/mol
• Exact Mass: 1337.28
• IUPAC Name: dipotassium;2-chloro-1-[4-(4-chloro-2-fluoro-5-methylphenyl)piperazin-1-yl]ethanone;1-[4-(4-chloro-2-fluoro-5-methylphenyl)piperazin-1-yl]-2-pyrazolo[3,4-b]pyridin-2-ylethanone;1-[4-(4-chloro-2-fluoro-5-methylphenyl)piperazin-1-yl]-2-pyrazolo[5,4-b]pyridin-1-ylethanone;hydride;oxido formate;1H-pyrazolo[5,4-b]pyridine
• SMILES: Cc1cc(N2CCN(C(=O)CCl)CC2)c(F)cc1Cl.Cc1cc(N2CCN(C(=O)Cn3cc4cccnc4n3)CC2)c(F)cc1Cl.Cc1cc(N2CCN(C(=O)Cn3ncc4cccnc43)CC2)c(F)cc1Cl.O=CO[O-].[H-].[K+].[K+].c1cnc2[nH]ncc2c1
• InChI: InChI=1S/2C19H19ClFN5O.C13H15Cl2FN2O.C6H5N3.CH2O3.2K.H/c1-13-9-17(16(21)10-15(13)20)24-5-7-25(8-6-24)18(27)12-26-11-14-3-2-4-22-19(14)23-26;1-13-9-17(16(21)10-15(13)20)24-5-7-25(8-6-24)18(27)12-26-19-14(11-23-26)3-2-4-22-19;1-9-6-12(11(16)7-10(9)15)17-2-4-18(5-3-17)13(19)8-14;1-2-5-4-8-9-6(5)7-3-1;2-1-4-3;;;/h2*2-4,9-11H,5-8,12H2,1H3;6-7H,2-5,8H2,1H3;1-4H,(H,7,8,9);1,3H;;;/q;;;;;2*+1;-1/p-1
• InChIKey: MTOIPYKEGBLMQT-UHFFFAOYSA-M
• XLogP: 1.95
• TPSA: 223.00 Ų
• H-Bond Donors: 1
• H-Bond Acceptors: 17
• Rotatable Bonds: 9
• Heavy Atoms: 88
• Complexity: —

Lipinski Rule of Five

2 violations

Rule	Value
MW ≤ 500	1340.22
LogP ≤ 5	1.95
H-Bond Donors ≤ 5	1
H-Bond Acceptors ≤ 10	17

Computed Properties (RDKit)

• Structural Alerts: {'alert_name': 'aldehyde', 'substructure': 'N/A'}, {'alert_name': 'alkyl_halide', 'substructure': 'N/A'}, {'alert_name': 'Oxygen-nitrogen_single_bond', 'substructure': 'N/A'}, {'alert_name': 'peroxide', 'substructure': 'N/A'}

Frequently Asked Questions

What is the IUPAC name of dipotassium;2-chloro-1-[4-(4-chloro-2-fluoro-5-methylphenyl)piperazin-1-yl]ethanone;1-[4-(4-chloro-2-fluoro-5-methylphenyl)piperazin-1-yl]-2-pyrazolo[3,4-b]pyridin-2-ylethanone;1-[4-(4-chloro-2-fluoro-5-methylphenyl)piperazin-1-yl]-2-pyrazolo[5,4-b]pyridin-1-ylethanone;hydride;oxido formate;1H-pyrazolo[5,4-b]pyridine?

The IUPAC name of dipotassium;2-chloro-1-[4-(4-chloro-2-fluoro-5-methylphenyl)piperazin-1-yl]ethanone;1-[4-(4-chloro-2-fluoro-5-methylphenyl)piperazin-1-yl]-2-pyrazolo[3,4-b]pyridin-2-ylethanone;1-[4-(4-chloro-2-fluoro-5-methylphenyl)piperazin-1-yl]-2-pyrazolo[5,4-b]pyridin-1-ylethanone;hydride;oxido formate;1H-pyrazolo[5,4-b]pyridine (CID 157085015) is dipotassium;2-chloro-1-[4-(4-chloro-2-fluoro-5-methylphenyl)piperazin-1-yl]ethanone;1-[4-(4-chloro-2-fluoro-5-methylphenyl)piperazin-1-yl]-2-pyrazolo[3,4-b]pyridin-2-ylethanone;1-[4-(4-chloro-2-fluoro-5-methylphenyl)piperazin-1-yl]-2-pyrazolo[5,4-b]pyridin-1-ylethanone;hydride;oxido formate;1H-pyrazolo[5,4-b]pyridine.

What is the SMILES notation for dipotassium;2-chloro-1-[4-(4-chloro-2-fluoro-5-methylphenyl)piperazin-1-yl]ethanone;1-[4-(4-chloro-2-fluoro-5-methylphenyl)piperazin-1-yl]-2-pyrazolo[3,4-b]pyridin-2-ylethanone;1-[4-(4-chloro-2-fluoro-5-methylphenyl)piperazin-1-yl]-2-pyrazolo[5,4-b]pyridin-1-ylethanone;hydride;oxido formate;1H-pyrazolo[5,4-b]pyridine?

The canonical SMILES for dipotassium;2-chloro-1-[4-(4-chloro-2-fluoro-5-methylphenyl)piperazin-1-yl]ethanone;1-[4-(4-chloro-2-fluoro-5-methylphenyl)piperazin-1-yl]-2-pyrazolo[3,4-b]pyridin-2-ylethanone;1-[4-(4-chloro-2-fluoro-5-methylphenyl)piperazin-1-yl]-2-pyrazolo[5,4-b]pyridin-1-ylethanone;hydride;oxido formate;1H-pyrazolo[5,4-b]pyridine is Cc1cc(N2CCN(C(=O)CCl)CC2)c(F)cc1Cl.Cc1cc(N2CCN(C(=O)Cn3cc4cccnc4n3)CC2)c(F)cc1Cl.Cc1cc(N2CCN(C(=O)Cn3ncc4cccnc43)CC2)c(F)cc1Cl.O=CO[O-].[H-].[K+].[K+].c1cnc2[nH]ncc2c1.

What is the InChIKey of dipotassium;2-chloro-1-[4-(4-chloro-2-fluoro-5-methylphenyl)piperazin-1-yl]ethanone;1-[4-(4-chloro-2-fluoro-5-methylphenyl)piperazin-1-yl]-2-pyrazolo[3,4-b]pyridin-2-ylethanone;1-[4-(4-chloro-2-fluoro-5-methylphenyl)piperazin-1-yl]-2-pyrazolo[5,4-b]pyridin-1-ylethanone;hydride;oxido formate;1H-pyrazolo[5,4-b]pyridine?

The InChIKey is MTOIPYKEGBLMQT-UHFFFAOYSA-M. The full InChI is InChI=1S/2C19H19ClFN5O.C13H15Cl2FN2O.C6H5N3.CH2O3.2K.H/c1-13-9-17(16(21)10-15(13)20)24-5-7-25(8-6-24)18(27)12-26-11-14-3-2-4-22-19(14)23-26;1-13-9-17(16(21)10-15(13)20)24-5-7-25(8-6-24)18(27)12-26-19-14(11-23-26)3-2-4-22-19;1-9-6-12(11(16)7-10(9)15)17-2-4-18(5-3-17)13(19)8-14;1-2-5-4-8-9-6(5)7-3-1;2-1-4-3;;;/h2*2-4,9-11H,5-8,12H2,1H3;6-7H,2-5,8H2,1H3;1-4H,(H,7,8,9);1,3H;;;/q;;;;;2*+1;-1/p-1.

What are the key properties of dipotassium;2-chloro-1-[4-(4-chloro-2-fluoro-5-methylphenyl)piperazin-1-yl]ethanone;1-[4-(4-chloro-2-fluoro-5-methylphenyl)piperazin-1-yl]-2-pyrazolo[3,4-b]pyridin-2-ylethanone;1-[4-(4-chloro-2-fluoro-5-methylphenyl)piperazin-1-yl]-2-pyrazolo[5,4-b]pyridin-1-ylethanone;hydride;oxido formate;1H-pyrazolo[5,4-b]pyridine?

dipotassium;2-chloro-1-[4-(4-chloro-2-fluoro-5-methylphenyl)piperazin-1-yl]ethanone;1-[4-(4-chloro-2-fluoro-5-methylphenyl)piperazin-1-yl]-2-pyrazolo[3,4-b]pyridin-2-ylethanone;1-[4-(4-chloro-2-fluoro-5-methylphenyl)piperazin-1-yl]-2-pyrazolo[5,4-b]pyridin-1-ylethanone;hydride;oxido formate;1H-pyrazolo[5,4-b]pyridine has a molecular weight of 1340.22 g/mol, XLogP of 1.95, 9 rotatable bonds, 1 hydrogen bond donors, and 17 hydrogen bond acceptors.

Where does this data come from?

All data for dipotassium;2-chloro-1-[4-(4-chloro-2-fluoro-5-methylphenyl)piperazin-1-yl]ethanone;1-[4-(4-chloro-2-fluoro-5-methylphenyl)piperazin-1-yl]-2-pyrazolo[3,4-b]pyridin-2-ylethanone;1-[4-(4-chloro-2-fluoro-5-methylphenyl)piperazin-1-yl]-2-pyrazolo[5,4-b]pyridin-1-ylethanone;hydride;oxido formate;1H-pyrazolo[5,4-b]pyridine is sourced from PubChem (CID 157085015), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).