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

C59H67Cl4K2N15O9 — CID 158028874

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

dipotassium;2-chloro-1-[4-(4-chloro-3-methoxyphenyl)piperazin-1-yl]ethanone;1-[4-(4-chloro-3-methoxyphenyl)piperazin-1-yl]-2-pyrazolo[3,4-b]pyridin-2-ylethanone;1-[4-(4-chloro-3-methoxyphenyl)piperazin-1-yl]-2-pyrazolo[5,4-b]pyridin-1-ylethanone;hydride;methane;oxido formate;1H-pyrazolo[5,4-b]pyridine (PubChem CID 158028874) has the molecular formula C59H67Cl4K2N15O9 and a molecular weight of 1350.29 g/mol. Its IUPAC name is dipotassium;2-chloro-1-[4-(4-chloro-3-methoxyphenyl)piperazin-1-yl]ethanone;1-[4-(4-chloro-3-methoxyphenyl)piperazin-1-yl]-2-pyrazolo[3,4-b]pyridin-2-ylethanone;1-[4-(4-chloro-3-methoxyphenyl)piperazin-1-yl]-2-pyrazolo[5,4-b]pyridin-1-ylethanone;hydride;methane;oxido formate;1H-pyrazolo[5,4-b]pyridine.

Molecular Properties

• Compound Name: dipotassium;2-chloro-1-[4-(4-chloro-3-methoxyphenyl)piperazin-1-yl]ethanone;1-[4-(4-chloro-3-methoxyphenyl)piperazin-1-yl]-2-pyrazolo[3,4-b]pyridin-2-ylethanone;1-[4-(4-chloro-3-methoxyphenyl)piperazin-1-yl]-2-pyrazolo[5,4-b]pyridin-1-ylethanone;hydride;methane;oxido formate;1H-pyrazolo[5,4-b]pyridine
• PubChem CID: 158028874
• Molecular Formula: C59H67Cl4K2N15O9
• Molecular Weight: 1350.29 g/mol
• Exact Mass: 1347.33
• IUPAC Name: dipotassium;2-chloro-1-[4-(4-chloro-3-methoxyphenyl)piperazin-1-yl]ethanone;1-[4-(4-chloro-3-methoxyphenyl)piperazin-1-yl]-2-pyrazolo[3,4-b]pyridin-2-ylethanone;1-[4-(4-chloro-3-methoxyphenyl)piperazin-1-yl]-2-pyrazolo[5,4-b]pyridin-1-ylethanone;hydride;methane;oxido formate;1H-pyrazolo[5,4-b]pyridine
• SMILES: C.COc1cc(N2CCN(C(=O)CCl)CC2)ccc1Cl.COc1cc(N2CCN(C(=O)Cn3cc4cccnc4n3)CC2)ccc1Cl.COc1cc(N2CCN(C(=O)Cn3ncc4cccnc43)CC2)ccc1Cl.O=CO[O-].[H-].[K+].[K+].c1cnc2[nH]ncc2c1
• InChI: InChI=1S/2C19H20ClN5O2.C13H16Cl2N2O2.C6H5N3.CH2O3.CH4.2K.H/c1-27-17-11-15(4-5-16(17)20)23-7-9-24(10-8-23)18(26)13-25-12-14-3-2-6-21-19(14)22-25;1-27-17-11-15(4-5-16(17)20)23-7-9-24(10-8-23)18(26)13-25-19-14(12-22-25)3-2-6-21-19;1-19-12-8-10(2-3-11(12)15)16-4-6-17(7-5-16)13(18)9-14;1-2-5-4-8-9-6(5)7-3-1;2-1-4-3;;;;/h2*2-6,11-12H,7-10,13H2,1H3;2-3,8H,4-7,9H2,1H3;1-4H,(H,7,8,9);1,3H;1H4;;;/q;;;;;;2*+1;-1/p-1
• InChIKey: YCCFVRCZXUHRSH-UHFFFAOYSA-M
• XLogP: 1.27
• TPSA: 250.69 Ų
• H-Bond Donors: 1
• H-Bond Acceptors: 20
• Rotatable Bonds: 12
• Heavy Atoms: 89
• Complexity: —

Lipinski Rule of Five

2 violations

Rule	Value
MW ≤ 500	1350.29
LogP ≤ 5	1.27
H-Bond Donors ≤ 5	1
H-Bond Acceptors ≤ 10	20

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

The IUPAC name of dipotassium;2-chloro-1-[4-(4-chloro-3-methoxyphenyl)piperazin-1-yl]ethanone;1-[4-(4-chloro-3-methoxyphenyl)piperazin-1-yl]-2-pyrazolo[3,4-b]pyridin-2-ylethanone;1-[4-(4-chloro-3-methoxyphenyl)piperazin-1-yl]-2-pyrazolo[5,4-b]pyridin-1-ylethanone;hydride;methane;oxido formate;1H-pyrazolo[5,4-b]pyridine (CID 158028874) is dipotassium;2-chloro-1-[4-(4-chloro-3-methoxyphenyl)piperazin-1-yl]ethanone;1-[4-(4-chloro-3-methoxyphenyl)piperazin-1-yl]-2-pyrazolo[3,4-b]pyridin-2-ylethanone;1-[4-(4-chloro-3-methoxyphenyl)piperazin-1-yl]-2-pyrazolo[5,4-b]pyridin-1-ylethanone;hydride;methane;oxido formate;1H-pyrazolo[5,4-b]pyridine.

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

The canonical SMILES for dipotassium;2-chloro-1-[4-(4-chloro-3-methoxyphenyl)piperazin-1-yl]ethanone;1-[4-(4-chloro-3-methoxyphenyl)piperazin-1-yl]-2-pyrazolo[3,4-b]pyridin-2-ylethanone;1-[4-(4-chloro-3-methoxyphenyl)piperazin-1-yl]-2-pyrazolo[5,4-b]pyridin-1-ylethanone;hydride;methane;oxido formate;1H-pyrazolo[5,4-b]pyridine is C.COc1cc(N2CCN(C(=O)CCl)CC2)ccc1Cl.COc1cc(N2CCN(C(=O)Cn3cc4cccnc4n3)CC2)ccc1Cl.COc1cc(N2CCN(C(=O)Cn3ncc4cccnc43)CC2)ccc1Cl.O=CO[O-].[H-].[K+].[K+].c1cnc2[nH]ncc2c1.

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

The InChIKey is YCCFVRCZXUHRSH-UHFFFAOYSA-M. The full InChI is InChI=1S/2C19H20ClN5O2.C13H16Cl2N2O2.C6H5N3.CH2O3.CH4.2K.H/c1-27-17-11-15(4-5-16(17)20)23-7-9-24(10-8-23)18(26)13-25-12-14-3-2-6-21-19(14)22-25;1-27-17-11-15(4-5-16(17)20)23-7-9-24(10-8-23)18(26)13-25-19-14(12-22-25)3-2-6-21-19;1-19-12-8-10(2-3-11(12)15)16-4-6-17(7-5-16)13(18)9-14;1-2-5-4-8-9-6(5)7-3-1;2-1-4-3;;;;/h2*2-6,11-12H,7-10,13H2,1H3;2-3,8H,4-7,9H2,1H3;1-4H,(H,7,8,9);1,3H;1H4;;;/q;;;;;;2*+1;-1/p-1.

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

dipotassium;2-chloro-1-[4-(4-chloro-3-methoxyphenyl)piperazin-1-yl]ethanone;1-[4-(4-chloro-3-methoxyphenyl)piperazin-1-yl]-2-pyrazolo[3,4-b]pyridin-2-ylethanone;1-[4-(4-chloro-3-methoxyphenyl)piperazin-1-yl]-2-pyrazolo[5,4-b]pyridin-1-ylethanone;hydride;methane;oxido formate;1H-pyrazolo[5,4-b]pyridine has a molecular weight of 1350.29 g/mol, XLogP of 1.27, 12 rotatable bonds, 1 hydrogen bond donors, and 20 hydrogen bond acceptors.

Where does this data come from?

All data for dipotassium;2-chloro-1-[4-(4-chloro-3-methoxyphenyl)piperazin-1-yl]ethanone;1-[4-(4-chloro-3-methoxyphenyl)piperazin-1-yl]-2-pyrazolo[3,4-b]pyridin-2-ylethanone;1-[4-(4-chloro-3-methoxyphenyl)piperazin-1-yl]-2-pyrazolo[5,4-b]pyridin-1-ylethanone;hydride;methane;oxido formate;1H-pyrazolo[5,4-b]pyridine is sourced from PubChem (CID 158028874), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).