3-[[6-(3,5-dichlorophenyl)pyrazolo[4,5-b]pyridin-1-yl]methyl]imidazo[1,2-a]pyridin-6-amine;6-(3-ethoxyphenyl)-1-[(6-nitrosoimidazo[1,2-a]pyridin-3-yl)methyl]pyrazolo[4,5-b]pyridine;6-(1-methylpyrazol-4-yl)-1-naphthalen-1-ylsulfonylpyrazolo[4,5-b]pyridine;6-(1-methylpyrazol-4-yl)-1-naphthalen-2-ylsulfonylpyrazolo[4,5-b]pyridine

C82H62Cl2N22O6S2 — CID 159062473

About 3-[[6-(3,5-dichlorophenyl)pyrazolo[4,5-b]pyridin-1-yl]methyl]imidazo[1,2-a]pyridin-6-amine;6-(3-ethoxyphenyl)-1-[(6-nitrosoimidazo[1,2-a]pyridin-3-yl)methyl]pyrazolo[4,5-b]pyridine;6-(1-methylpyrazol-4-yl)-1-naphthalen-1-ylsulfonylpyrazolo[4,5-b]pyridine;6-(1-methylpyrazol-4-yl)-1-naphthalen-2-ylsulfonylpyrazolo[4,5-b]pyridine

3-[[6-(3,5-dichlorophenyl)pyrazolo[4,5-b]pyridin-1-yl]methyl]imidazo[1,2-a]pyridin-6-amine;6-(3-ethoxyphenyl)-1-[(6-nitrosoimidazo[1,2-a]pyridin-3-yl)methyl]pyrazolo[4,5-b]pyridine;6-(1-methylpyrazol-4-yl)-1-naphthalen-1-ylsulfonylpyrazolo[4,5-b]pyridine;6-(1-methylpyrazol-4-yl)-1-naphthalen-2-ylsulfonylpyrazolo[4,5-b]pyridine (PubChem CID 159062473) has the molecular formula C82H62Cl2N22O6S2 and a molecular weight of 1586.59 g/mol. Its IUPAC name is 3-[[6-(3,5-dichlorophenyl)pyrazolo[4,5-b]pyridin-1-yl]methyl]imidazo[1,2-a]pyridin-6-amine;6-(3-ethoxyphenyl)-1-[(6-nitrosoimidazo[1,2-a]pyridin-3-yl)methyl]pyrazolo[4,5-b]pyridine;6-(1-methylpyrazol-4-yl)-1-naphthalen-1-ylsulfonylpyrazolo[4,5-b]pyridine;6-(1-methylpyrazol-4-yl)-1-naphthalen-2-ylsulfonylpyrazolo[4,5-b]pyridine.

Molecular Properties

• Compound Name: 3-[[6-(3,5-dichlorophenyl)pyrazolo[4,5-b]pyridin-1-yl]methyl]imidazo[1,2-a]pyridin-6-amine;6-(3-ethoxyphenyl)-1-[(6-nitrosoimidazo[1,2-a]pyridin-3-yl)methyl]pyrazolo[4,5-b]pyridine;6-(1-methylpyrazol-4-yl)-1-naphthalen-1-ylsulfonylpyrazolo[4,5-b]pyridine;6-(1-methylpyrazol-4-yl)-1-naphthalen-2-ylsulfonylpyrazolo[4,5-b]pyridine
• PubChem CID: 159062473
• Molecular Formula: C82H62Cl2N22O6S2
• Molecular Weight: 1586.59 g/mol
• Exact Mass: 1584.40
• IUPAC Name: 3-[[6-(3,5-dichlorophenyl)pyrazolo[4,5-b]pyridin-1-yl]methyl]imidazo[1,2-a]pyridin-6-amine;6-(3-ethoxyphenyl)-1-[(6-nitrosoimidazo[1,2-a]pyridin-3-yl)methyl]pyrazolo[4,5-b]pyridine;6-(1-methylpyrazol-4-yl)-1-naphthalen-1-ylsulfonylpyrazolo[4,5-b]pyridine;6-(1-methylpyrazol-4-yl)-1-naphthalen-2-ylsulfonylpyrazolo[4,5-b]pyridine
• SMILES: CCOc1cccc(-c2cnc3cnn(Cc4cnc5ccc(N=O)cn45)c3c2)c1.Cn1cc(-c2cnc3cnn(S(=O)(=O)c4ccc5ccccc5c4)c3c2)cn1.Cn1cc(-c2cnc3cnn(S(=O)(=O)c4cccc5ccccc45)c3c2)cn1.Nc1ccc2ncc(Cn3ncc4ncc(-c5cc(Cl)cc(Cl)c5)cc43)n2c1
• InChI: InChI=1S/C22H18N6O2.C20H14Cl2N6.2C20H15N5O2S/c1-2-30-19-5-3-4-15(8-19)16-9-21-20(23-10-16)12-25-28(21)14-18-11-24-22-7-6-17(26-29)13-27(18)22;21-14-3-12(4-15(22)6-14)13-5-19-18(24-7-13)9-26-28(19)11-17-8-25-20-2-1-16(23)10-27(17)20;1-24-13-16(11-22-24)15-9-19-18(21-10-15)12-23-25(19)28(26,27)20-8-4-6-14-5-2-3-7-17(14)20;1-24-13-17(11-22-24)16-9-20-19(21-10-16)12-23-25(20)28(26,27)18-7-6-14-4-2-3-5-15(14)8-18/h3-13H,2,14H2,1H3;1-10H,11,23H2;2*2-13H,1H3
• InChIKey: JYQIGURMETUXFI-UHFFFAOYSA-N
• XLogP: 15.72
• TPSA: 326.04 Ų
• H-Bond Donors: 1
• H-Bond Acceptors: 28
• Rotatable Bonds: 15
• Heavy Atoms: 114
• Complexity: —

Lipinski Rule of Five

3 violations

Rule	Value
MW ≤ 500	1586.59
LogP ≤ 5	15.72
H-Bond Donors ≤ 5	1
H-Bond Acceptors ≤ 10	28

Frequently Asked Questions

What is the IUPAC name of 3-[[6-(3,5-dichlorophenyl)pyrazolo[4,5-b]pyridin-1-yl]methyl]imidazo[1,2-a]pyridin-6-amine;6-(3-ethoxyphenyl)-1-[(6-nitrosoimidazo[1,2-a]pyridin-3-yl)methyl]pyrazolo[4,5-b]pyridine;6-(1-methylpyrazol-4-yl)-1-naphthalen-1-ylsulfonylpyrazolo[4,5-b]pyridine;6-(1-methylpyrazol-4-yl)-1-naphthalen-2-ylsulfonylpyrazolo[4,5-b]pyridine?

The IUPAC name of 3-[[6-(3,5-dichlorophenyl)pyrazolo[4,5-b]pyridin-1-yl]methyl]imidazo[1,2-a]pyridin-6-amine;6-(3-ethoxyphenyl)-1-[(6-nitrosoimidazo[1,2-a]pyridin-3-yl)methyl]pyrazolo[4,5-b]pyridine;6-(1-methylpyrazol-4-yl)-1-naphthalen-1-ylsulfonylpyrazolo[4,5-b]pyridine;6-(1-methylpyrazol-4-yl)-1-naphthalen-2-ylsulfonylpyrazolo[4,5-b]pyridine (CID 159062473) is 3-[[6-(3,5-dichlorophenyl)pyrazolo[4,5-b]pyridin-1-yl]methyl]imidazo[1,2-a]pyridin-6-amine;6-(3-ethoxyphenyl)-1-[(6-nitrosoimidazo[1,2-a]pyridin-3-yl)methyl]pyrazolo[4,5-b]pyridine;6-(1-methylpyrazol-4-yl)-1-naphthalen-1-ylsulfonylpyrazolo[4,5-b]pyridine;6-(1-methylpyrazol-4-yl)-1-naphthalen-2-ylsulfonylpyrazolo[4,5-b]pyridine.

What is the SMILES notation for 3-[[6-(3,5-dichlorophenyl)pyrazolo[4,5-b]pyridin-1-yl]methyl]imidazo[1,2-a]pyridin-6-amine;6-(3-ethoxyphenyl)-1-[(6-nitrosoimidazo[1,2-a]pyridin-3-yl)methyl]pyrazolo[4,5-b]pyridine;6-(1-methylpyrazol-4-yl)-1-naphthalen-1-ylsulfonylpyrazolo[4,5-b]pyridine;6-(1-methylpyrazol-4-yl)-1-naphthalen-2-ylsulfonylpyrazolo[4,5-b]pyridine?

The canonical SMILES for 3-[[6-(3,5-dichlorophenyl)pyrazolo[4,5-b]pyridin-1-yl]methyl]imidazo[1,2-a]pyridin-6-amine;6-(3-ethoxyphenyl)-1-[(6-nitrosoimidazo[1,2-a]pyridin-3-yl)methyl]pyrazolo[4,5-b]pyridine;6-(1-methylpyrazol-4-yl)-1-naphthalen-1-ylsulfonylpyrazolo[4,5-b]pyridine;6-(1-methylpyrazol-4-yl)-1-naphthalen-2-ylsulfonylpyrazolo[4,5-b]pyridine is CCOc1cccc(-c2cnc3cnn(Cc4cnc5ccc(N=O)cn45)c3c2)c1.Cn1cc(-c2cnc3cnn(S(=O)(=O)c4ccc5ccccc5c4)c3c2)cn1.Cn1cc(-c2cnc3cnn(S(=O)(=O)c4cccc5ccccc45)c3c2)cn1.Nc1ccc2ncc(Cn3ncc4ncc(-c5cc(Cl)cc(Cl)c5)cc43)n2c1.

What is the InChIKey of 3-[[6-(3,5-dichlorophenyl)pyrazolo[4,5-b]pyridin-1-yl]methyl]imidazo[1,2-a]pyridin-6-amine;6-(3-ethoxyphenyl)-1-[(6-nitrosoimidazo[1,2-a]pyridin-3-yl)methyl]pyrazolo[4,5-b]pyridine;6-(1-methylpyrazol-4-yl)-1-naphthalen-1-ylsulfonylpyrazolo[4,5-b]pyridine;6-(1-methylpyrazol-4-yl)-1-naphthalen-2-ylsulfonylpyrazolo[4,5-b]pyridine?

The InChIKey is JYQIGURMETUXFI-UHFFFAOYSA-N. The full InChI is InChI=1S/C22H18N6O2.C20H14Cl2N6.2C20H15N5O2S/c1-2-30-19-5-3-4-15(8-19)16-9-21-20(23-10-16)12-25-28(21)14-18-11-24-22-7-6-17(26-29)13-27(18)22;21-14-3-12(4-15(22)6-14)13-5-19-18(24-7-13)9-26-28(19)11-17-8-25-20-2-1-16(23)10-27(17)20;1-24-13-16(11-22-24)15-9-19-18(21-10-15)12-23-25(19)28(26,27)20-8-4-6-14-5-2-3-7-17(14)20;1-24-13-17(11-22-24)16-9-20-19(21-10-16)12-23-25(20)28(26,27)18-7-6-14-4-2-3-5-15(14)8-18/h3-13H,2,14H2,1H3;1-10H,11,23H2;2*2-13H,1H3.

What are the key properties of 3-[[6-(3,5-dichlorophenyl)pyrazolo[4,5-b]pyridin-1-yl]methyl]imidazo[1,2-a]pyridin-6-amine;6-(3-ethoxyphenyl)-1-[(6-nitrosoimidazo[1,2-a]pyridin-3-yl)methyl]pyrazolo[4,5-b]pyridine;6-(1-methylpyrazol-4-yl)-1-naphthalen-1-ylsulfonylpyrazolo[4,5-b]pyridine;6-(1-methylpyrazol-4-yl)-1-naphthalen-2-ylsulfonylpyrazolo[4,5-b]pyridine?

3-[[6-(3,5-dichlorophenyl)pyrazolo[4,5-b]pyridin-1-yl]methyl]imidazo[1,2-a]pyridin-6-amine;6-(3-ethoxyphenyl)-1-[(6-nitrosoimidazo[1,2-a]pyridin-3-yl)methyl]pyrazolo[4,5-b]pyridine;6-(1-methylpyrazol-4-yl)-1-naphthalen-1-ylsulfonylpyrazolo[4,5-b]pyridine;6-(1-methylpyrazol-4-yl)-1-naphthalen-2-ylsulfonylpyrazolo[4,5-b]pyridine has a molecular weight of 1586.59 g/mol, XLogP of 15.72, 15 rotatable bonds, 1 hydrogen bond donors, and 28 hydrogen bond acceptors.

Where does this data come from?

All data for 3-[[6-(3,5-dichlorophenyl)pyrazolo[4,5-b]pyridin-1-yl]methyl]imidazo[1,2-a]pyridin-6-amine;6-(3-ethoxyphenyl)-1-[(6-nitrosoimidazo[1,2-a]pyridin-3-yl)methyl]pyrazolo[4,5-b]pyridine;6-(1-methylpyrazol-4-yl)-1-naphthalen-1-ylsulfonylpyrazolo[4,5-b]pyridine;6-(1-methylpyrazol-4-yl)-1-naphthalen-2-ylsulfonylpyrazolo[4,5-b]pyridine is sourced from PubChem (CID 159062473), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).