1-benzyl-4-chloro-N-(4-chlorophenyl)-3-methylpyrrolo[2,3-b]pyridine-5-carboxamide;1-benzyl-4-chloro-3-methyl-N-(4-methylphenyl)pyrrolo[2,3-b]pyridine-5-carboxamide;1-benzyl-4-chloro-3-methyl-N-(4-propan-2-ylphenyl)pyrrolo[2,3-b]pyridine-5-carboxamide;4-chloro-N-(4-chlorophenyl)-3-methyl-1-[(5-methyl-3-pyridinyl)methyl]pyrazolo[3,4-b]pyridine-5-carboxamide;4-chloro-3-methyl-N-(4-methylphenyl)-1-[(5-methyl-3-pyridinyl)methyl]pyrazolo[3,4-b]pyridine-5-carboxamide;4-chloro-3-methyl-N-(4-propan-2-ylphenyl)-1-(pyridin-2-ylmethyl)pyrazolo[3,4-b]pyridine-5-carboxamide

C136H120Cl8N24O6 — CID 158845151

IUPAC1-benzyl-4-chloro-N-(4-chlorophenyl)-3-methylpyrrolo[2,3-b]pyridine-5-carboxamide;1-benzyl-4-chloro-3-methyl-N-(4-methylphenyl)pyrrolo[2,3-b]pyridine-5-carboxamide;1-benzyl-4-chloro-3-methyl-N-(4-propan-2-ylphenyl)pyrrolo[2,3-b]pyridine-5-carboxamide;4-chloro-N-(4-chlorophenyl)-3-methyl-1-[(5-methyl-3-pyridinyl)methyl]pyrazolo[3,4-b]pyridine-5-carboxamide;4-chloro-3-methyl-N-(4-methylphenyl)-1-[(5-methyl-3-pyridinyl)methyl]pyrazolo[3,4-b]pyridine-5-carboxamide;4-chloro-3-methyl-N-(4-propan-2-ylphenyl)-1-(pyridin-2-ylmethyl)pyrazolo[3,4-b]pyridine-5-carboxamide
SMILESCc1ccc(NC(=O)c2cnc3c(c(C)cn3Cc3ccccc3)c2Cl)cc1.Cc1ccc(NC(=O)c2cnc3c(c(C)nn3Cc3cncc(C)c3)c2Cl)cc1.Cc1cn(Cc2ccccc2)c2ncc(C(=O)Nc3ccc(C(C)C)cc3)c(Cl)c12.Cc1cn(Cc2ccccc2)c2ncc(C(=O)Nc3ccc(Cl)cc3)c(Cl)c12.Cc1cncc(Cn2nc(C)c3c(Cl)c(C(=O)Nc4ccc(Cl)cc4)cnc32)c1.Cc1nn(Cc2ccccn2)c2ncc(C(=O)Nc3ccc(C(C)C)cc3)c(Cl)c12
InChIInChI=1S/C25H24ClN3O.C23H22ClN5O.C23H20ClN3O.C22H17Cl2N3O.C22H20ClN5O.C21H17Cl2N5O/c1-16(2)19-9-11-20(12-10-19)28-25(30)21-13-27-24-22(23(21)26)17(3)14-29(24)15-18-7-5-4-6-8-18;1-14(2)16-7-9-17(10-8-16)27-23(30)19-12-26-22-20(21(19)24)15(3)28-29(22)13-18-6-4-5-11-25-18;1-15-8-10-18(11-9-15)26-23(28)19-12-25-22-20(21(19)24)16(2)13-27(22)14-17-6-4-3-5-7-17;1-14-12-27(13-15-5-3-2-4-6-15)21-19(14)20(24)18(11-25-21)22(28)26-17-9-7-16(23)8-10-17;1-13-4-6-17(7-5-13)26-22(29)18-11-25-21-19(20(18)23)15(3)27-28(21)12-16-8-14(2)9-24-10-16;1-12-7-14(9-24-8-12)11-28-20-18(13(2)27-28)19(23)17(10-25-20)21(29)26-16-5-3-15(22)4-6-16/h4-14,16H,15H2,1-3H3,(H,28,30);4-12,14H,13H2,1-3H3,(H,27,30);3-13H,14H2,1-2H3,(H,26,28);2-12H,13H2,1H3,(H,26,28);4-11H,12H2,1-3H3,(H,26,29);3-10H,11H2,1-2H3,(H,26,29)
InChIKeyIYSPPORMISKCSL-UHFFFAOYSA-N
MW2470.24 g/mol
LogP32.95
Rot. Bonds26

About 1-benzyl-4-chloro-N-(4-chlorophenyl)-3-methylpyrrolo[2,3-b]pyridine-5-carboxamide;1-benzyl-4-chloro-3-methyl-N-(4-methylphenyl)pyrrolo[2,3-b]pyridine-5-carboxamide;1-benzyl-4-chloro-3-methyl-N-(4-propan-2-ylphenyl)pyrrolo[2,3-b]pyridine-5-carboxamide;4-chloro-N-(4-chlorophenyl)-3-methyl-1-[(5-methyl-3-pyridinyl)methyl]pyrazolo[3,4-b]pyridine-5-carboxamide;4-chloro-3-methyl-N-(4-methylphenyl)-1-[(5-methyl-3-pyridinyl)methyl]pyrazolo[3,4-b]pyridine-5-carboxamide;4-chloro-3-methyl-N-(4-propan-2-ylphenyl)-1-(pyridin-2-ylmethyl)pyrazolo[3,4-b]pyridine-5-carboxamide

1-benzyl-4-chloro-N-(4-chlorophenyl)-3-methylpyrrolo[2,3-b]pyridine-5-carboxamide;1-benzyl-4-chloro-3-methyl-N-(4-methylphenyl)pyrrolo[2,3-b]pyridine-5-carboxamide;1-benzyl-4-chloro-3-methyl-N-(4-propan-2-ylphenyl)pyrrolo[2,3-b]pyridine-5-carboxamide;4-chloro-N-(4-chlorophenyl)-3-methyl-1-[(5-methyl-3-pyridinyl)methyl]pyrazolo[3,4-b]pyridine-5-carboxamide;4-chloro-3-methyl-N-(4-methylphenyl)-1-[(5-methyl-3-pyridinyl)methyl]pyrazolo[3,4-b]pyridine-5-carboxamide;4-chloro-3-methyl-N-(4-propan-2-ylphenyl)-1-(pyridin-2-ylmethyl)pyrazolo[3,4-b]pyridine-5-carboxamide (PubChem CID 158845151) has the molecular formula C136H120Cl8N24O6 and a molecular weight of 2470.24 g/mol. Its IUPAC name is 1-benzyl-4-chloro-N-(4-chlorophenyl)-3-methylpyrrolo[2,3-b]pyridine-5-carboxamide;1-benzyl-4-chloro-3-methyl-N-(4-methylphenyl)pyrrolo[2,3-b]pyridine-5-carboxamide;1-benzyl-4-chloro-3-methyl-N-(4-propan-2-ylphenyl)pyrrolo[2,3-b]pyridine-5-carboxamide;4-chloro-N-(4-chlorophenyl)-3-methyl-1-[(5-methyl-3-pyridinyl)methyl]pyrazolo[3,4-b]pyridine-5-carboxamide;4-chloro-3-methyl-N-(4-methylphenyl)-1-[(5-methyl-3-pyridinyl)methyl]pyrazolo[3,4-b]pyridine-5-carboxamide;4-chloro-3-methyl-N-(4-propan-2-ylphenyl)-1-(pyridin-2-ylmethyl)pyrazolo[3,4-b]pyridine-5-carboxamide.

Molecular Properties

Compound Name1-benzyl-4-chloro-N-(4-chlorophenyl)-3-methylpyrrolo[2,3-b]pyridine-5-carboxamide;1-benzyl-4-chloro-3-methyl-N-(4-methylphenyl)pyrrolo[2,3-b]pyridine-5-carboxamide;1-benzyl-4-chloro-3-methyl-N-(4-propan-2-ylphenyl)pyrrolo[2,3-b]pyridine-5-carboxamide;4-chloro-N-(4-chlorophenyl)-3-methyl-1-[(5-methyl-3-pyridinyl)methyl]pyrazolo[3,4-b]pyridine-5-carboxamide;4-chloro-3-methyl-N-(4-methylphenyl)-1-[(5-methyl-3-pyridinyl)methyl]pyrazolo[3,4-b]pyridine-5-carboxamide;4-chloro-3-methyl-N-(4-propan-2-ylphenyl)-1-(pyridin-2-ylmethyl)pyrazolo[3,4-b]pyridine-5-carboxamide
PubChem CID158845151
Molecular FormulaC136H120Cl8N24O6
Molecular Weight2470.24 g/mol
Exact Mass2464.73
IUPAC Name1-benzyl-4-chloro-N-(4-chlorophenyl)-3-methylpyrrolo[2,3-b]pyridine-5-carboxamide;1-benzyl-4-chloro-3-methyl-N-(4-methylphenyl)pyrrolo[2,3-b]pyridine-5-carboxamide;1-benzyl-4-chloro-3-methyl-N-(4-propan-2-ylphenyl)pyrrolo[2,3-b]pyridine-5-carboxamide;4-chloro-N-(4-chlorophenyl)-3-methyl-1-[(5-methyl-3-pyridinyl)methyl]pyrazolo[3,4-b]pyridine-5-carboxamide;4-chloro-3-methyl-N-(4-methylphenyl)-1-[(5-methyl-3-pyridinyl)methyl]pyrazolo[3,4-b]pyridine-5-carboxamide;4-chloro-3-methyl-N-(4-propan-2-ylphenyl)-1-(pyridin-2-ylmethyl)pyrazolo[3,4-b]pyridine-5-carboxamide
SMILESCc1ccc(NC(=O)c2cnc3c(c(C)cn3Cc3ccccc3)c2Cl)cc1.Cc1ccc(NC(=O)c2cnc3c(c(C)nn3Cc3cncc(C)c3)c2Cl)cc1.Cc1cn(Cc2ccccc2)c2ncc(C(=O)Nc3ccc(C(C)C)cc3)c(Cl)c12.Cc1cn(Cc2ccccc2)c2ncc(C(=O)Nc3ccc(Cl)cc3)c(Cl)c12.Cc1cncc(Cn2nc(C)c3c(Cl)c(C(=O)Nc4ccc(Cl)cc4)cnc32)c1.Cc1nn(Cc2ccccn2)c2ncc(C(=O)Nc3ccc(C(C)C)cc3)c(Cl)c12
InChIInChI=1S/C25H24ClN3O.C23H22ClN5O.C23H20ClN3O.C22H17Cl2N3O.C22H20ClN5O.C21H17Cl2N5O/c1-16(2)19-9-11-20(12-10-19)28-25(30)21-13-27-24-22(23(21)26)17(3)14-29(24)15-18-7-5-4-6-8-18;1-14(2)16-7-9-17(10-8-16)27-23(30)19-12-26-22-20(21(19)24)15(3)28-29(22)13-18-6-4-5-11-25-18;1-15-8-10-18(11-9-15)26-23(28)19-12-25-22-20(21(19)24)16(2)13-27(22)14-17-6-4-3-5-7-17;1-14-12-27(13-15-5-3-2-4-6-15)21-19(14)20(24)18(11-25-21)22(28)26-17-9-7-16(23)8-10-17;1-13-4-6-17(7-5-13)26-22(29)18-11-25-21-19(20(18)23)15(3)27-28(21)12-16-8-14(2)9-24-10-16;1-12-7-14(9-24-8-12)11-28-20-18(13(2)27-28)19(23)17(10-25-20)21(29)26-16-5-3-15(22)4-6-16/h4-14,16H,15H2,1-3H3,(H,28,30);4-12,14H,13H2,1-3H3,(H,27,30);3-13H,14H2,1-2H3,(H,26,28);2-12H,13H2,1H3,(H,26,28);4-11H,12H2,1-3H3,(H,26,29);3-10H,11H2,1-2H3,(H,26,29)
InChIKeyIYSPPORMISKCSL-UHFFFAOYSA-N
XLogP32.95
TPSA358.86 Ų
H-Bond Donors6
H-Bond Acceptors24
Rotatable Bonds26
Heavy Atoms174
Complexity—

Lipinski Rule of Five

4 violations

RuleValue
MW ≤ 5002470.24
LogP ≤ 532.95
H-Bond Donors ≤ 56
H-Bond Acceptors ≤ 1024

Analyze 1-benzyl-4-chloro-N-(4-chlorophenyl)-3-methylpyrrolo[2,3-b]pyridine-5-carboxamide;1-benzyl-4-chloro-3-methyl-N-(4-methylphenyl)pyrrolo[2,3-b]pyridine-5-carboxamide;1-benzyl-4-chloro-3-methyl-N-(4-propan-2-ylphenyl)pyrrolo[2,3-b]pyridine-5-carboxamide;4-chloro-N-(4-chlorophenyl)-3-methyl-1-[(5-methyl-3-pyridinyl)methyl]pyrazolo[3,4-b]pyridine-5-carboxamide;4-chloro-3-methyl-N-(4-methylphenyl)-1-[(5-methyl-3-pyridinyl)methyl]pyrazolo[3,4-b]pyridine-5-carboxamide;4-chloro-3-methyl-N-(4-propan-2-ylphenyl)-1-(pyridin-2-ylmethyl)pyrazolo[3,4-b]pyridine-5-carboxamide with MolForge

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Related Compounds

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Frequently Asked Questions

What is the IUPAC name of 1-benzyl-4-chloro-N-(4-chlorophenyl)-3-methylpyrrolo[2,3-b]pyridine-5-carboxamide;1-benzyl-4-chloro-3-methyl-N-(4-methylphenyl)pyrrolo[2,3-b]pyridine-5-carboxamide;1-benzyl-4-chloro-3-methyl-N-(4-propan-2-ylphenyl)pyrrolo[2,3-b]pyridine-5-carboxamide;4-chloro-N-(4-chlorophenyl)-3-methyl-1-[(5-methyl-3-pyridinyl)methyl]pyrazolo[3,4-b]pyridine-5-carboxamide;4-chloro-3-methyl-N-(4-methylphenyl)-1-[(5-methyl-3-pyridinyl)methyl]pyrazolo[3,4-b]pyridine-5-carboxamide;4-chloro-3-methyl-N-(4-propan-2-ylphenyl)-1-(pyridin-2-ylmethyl)pyrazolo[3,4-b]pyridine-5-carboxamide?
The IUPAC name of 1-benzyl-4-chloro-N-(4-chlorophenyl)-3-methylpyrrolo[2,3-b]pyridine-5-carboxamide;1-benzyl-4-chloro-3-methyl-N-(4-methylphenyl)pyrrolo[2,3-b]pyridine-5-carboxamide;1-benzyl-4-chloro-3-methyl-N-(4-propan-2-ylphenyl)pyrrolo[2,3-b]pyridine-5-carboxamide;4-chloro-N-(4-chlorophenyl)-3-methyl-1-[(5-methyl-3-pyridinyl)methyl]pyrazolo[3,4-b]pyridine-5-carboxamide;4-chloro-3-methyl-N-(4-methylphenyl)-1-[(5-methyl-3-pyridinyl)methyl]pyrazolo[3,4-b]pyridine-5-carboxamide;4-chloro-3-methyl-N-(4-propan-2-ylphenyl)-1-(pyridin-2-ylmethyl)pyrazolo[3,4-b]pyridine-5-carboxamide (CID 158845151) is 1-benzyl-4-chloro-N-(4-chlorophenyl)-3-methylpyrrolo[2,3-b]pyridine-5-carboxamide;1-benzyl-4-chloro-3-methyl-N-(4-methylphenyl)pyrrolo[2,3-b]pyridine-5-carboxamide;1-benzyl-4-chloro-3-methyl-N-(4-propan-2-ylphenyl)pyrrolo[2,3-b]pyridine-5-carboxamide;4-chloro-N-(4-chlorophenyl)-3-methyl-1-[(5-methyl-3-pyridinyl)methyl]pyrazolo[3,4-b]pyridine-5-carboxamide;4-chloro-3-methyl-N-(4-methylphenyl)-1-[(5-methyl-3-pyridinyl)methyl]pyrazolo[3,4-b]pyridine-5-carboxamide;4-chloro-3-methyl-N-(4-propan-2-ylphenyl)-1-(pyridin-2-ylmethyl)pyrazolo[3,4-b]pyridine-5-carboxamide.
What is the SMILES notation for 1-benzyl-4-chloro-N-(4-chlorophenyl)-3-methylpyrrolo[2,3-b]pyridine-5-carboxamide;1-benzyl-4-chloro-3-methyl-N-(4-methylphenyl)pyrrolo[2,3-b]pyridine-5-carboxamide;1-benzyl-4-chloro-3-methyl-N-(4-propan-2-ylphenyl)pyrrolo[2,3-b]pyridine-5-carboxamide;4-chloro-N-(4-chlorophenyl)-3-methyl-1-[(5-methyl-3-pyridinyl)methyl]pyrazolo[3,4-b]pyridine-5-carboxamide;4-chloro-3-methyl-N-(4-methylphenyl)-1-[(5-methyl-3-pyridinyl)methyl]pyrazolo[3,4-b]pyridine-5-carboxamide;4-chloro-3-methyl-N-(4-propan-2-ylphenyl)-1-(pyridin-2-ylmethyl)pyrazolo[3,4-b]pyridine-5-carboxamide?
The canonical SMILES for 1-benzyl-4-chloro-N-(4-chlorophenyl)-3-methylpyrrolo[2,3-b]pyridine-5-carboxamide;1-benzyl-4-chloro-3-methyl-N-(4-methylphenyl)pyrrolo[2,3-b]pyridine-5-carboxamide;1-benzyl-4-chloro-3-methyl-N-(4-propan-2-ylphenyl)pyrrolo[2,3-b]pyridine-5-carboxamide;4-chloro-N-(4-chlorophenyl)-3-methyl-1-[(5-methyl-3-pyridinyl)methyl]pyrazolo[3,4-b]pyridine-5-carboxamide;4-chloro-3-methyl-N-(4-methylphenyl)-1-[(5-methyl-3-pyridinyl)methyl]pyrazolo[3,4-b]pyridine-5-carboxamide;4-chloro-3-methyl-N-(4-propan-2-ylphenyl)-1-(pyridin-2-ylmethyl)pyrazolo[3,4-b]pyridine-5-carboxamide is Cc1ccc(NC(=O)c2cnc3c(c(C)cn3Cc3ccccc3)c2Cl)cc1.Cc1ccc(NC(=O)c2cnc3c(c(C)nn3Cc3cncc(C)c3)c2Cl)cc1.Cc1cn(Cc2ccccc2)c2ncc(C(=O)Nc3ccc(C(C)C)cc3)c(Cl)c12.Cc1cn(Cc2ccccc2)c2ncc(C(=O)Nc3ccc(Cl)cc3)c(Cl)c12.Cc1cncc(Cn2nc(C)c3c(Cl)c(C(=O)Nc4ccc(Cl)cc4)cnc32)c1.Cc1nn(Cc2ccccn2)c2ncc(C(=O)Nc3ccc(C(C)C)cc3)c(Cl)c12.
What is the InChIKey of 1-benzyl-4-chloro-N-(4-chlorophenyl)-3-methylpyrrolo[2,3-b]pyridine-5-carboxamide;1-benzyl-4-chloro-3-methyl-N-(4-methylphenyl)pyrrolo[2,3-b]pyridine-5-carboxamide;1-benzyl-4-chloro-3-methyl-N-(4-propan-2-ylphenyl)pyrrolo[2,3-b]pyridine-5-carboxamide;4-chloro-N-(4-chlorophenyl)-3-methyl-1-[(5-methyl-3-pyridinyl)methyl]pyrazolo[3,4-b]pyridine-5-carboxamide;4-chloro-3-methyl-N-(4-methylphenyl)-1-[(5-methyl-3-pyridinyl)methyl]pyrazolo[3,4-b]pyridine-5-carboxamide;4-chloro-3-methyl-N-(4-propan-2-ylphenyl)-1-(pyridin-2-ylmethyl)pyrazolo[3,4-b]pyridine-5-carboxamide?
The InChIKey is IYSPPORMISKCSL-UHFFFAOYSA-N. The full InChI is InChI=1S/C25H24ClN3O.C23H22ClN5O.C23H20ClN3O.C22H17Cl2N3O.C22H20ClN5O.C21H17Cl2N5O/c1-16(2)19-9-11-20(12-10-19)28-25(30)21-13-27-24-22(23(21)26)17(3)14-29(24)15-18-7-5-4-6-8-18;1-14(2)16-7-9-17(10-8-16)27-23(30)19-12-26-22-20(21(19)24)15(3)28-29(22)13-18-6-4-5-11-25-18;1-15-8-10-18(11-9-15)26-23(28)19-12-25-22-20(21(19)24)16(2)13-27(22)14-17-6-4-3-5-7-17;1-14-12-27(13-15-5-3-2-4-6-15)21-19(14)20(24)18(11-25-21)22(28)26-17-9-7-16(23)8-10-17;1-13-4-6-17(7-5-13)26-22(29)18-11-25-21-19(20(18)23)15(3)27-28(21)12-16-8-14(2)9-24-10-16;1-12-7-14(9-24-8-12)11-28-20-18(13(2)27-28)19(23)17(10-25-20)21(29)26-16-5-3-15(22)4-6-16/h4-14,16H,15H2,1-3H3,(H,28,30);4-12,14H,13H2,1-3H3,(H,27,30);3-13H,14H2,1-2H3,(H,26,28);2-12H,13H2,1H3,(H,26,28);4-11H,12H2,1-3H3,(H,26,29);3-10H,11H2,1-2H3,(H,26,29).
What are the key properties of 1-benzyl-4-chloro-N-(4-chlorophenyl)-3-methylpyrrolo[2,3-b]pyridine-5-carboxamide;1-benzyl-4-chloro-3-methyl-N-(4-methylphenyl)pyrrolo[2,3-b]pyridine-5-carboxamide;1-benzyl-4-chloro-3-methyl-N-(4-propan-2-ylphenyl)pyrrolo[2,3-b]pyridine-5-carboxamide;4-chloro-N-(4-chlorophenyl)-3-methyl-1-[(5-methyl-3-pyridinyl)methyl]pyrazolo[3,4-b]pyridine-5-carboxamide;4-chloro-3-methyl-N-(4-methylphenyl)-1-[(5-methyl-3-pyridinyl)methyl]pyrazolo[3,4-b]pyridine-5-carboxamide;4-chloro-3-methyl-N-(4-propan-2-ylphenyl)-1-(pyridin-2-ylmethyl)pyrazolo[3,4-b]pyridine-5-carboxamide?
1-benzyl-4-chloro-N-(4-chlorophenyl)-3-methylpyrrolo[2,3-b]pyridine-5-carboxamide;1-benzyl-4-chloro-3-methyl-N-(4-methylphenyl)pyrrolo[2,3-b]pyridine-5-carboxamide;1-benzyl-4-chloro-3-methyl-N-(4-propan-2-ylphenyl)pyrrolo[2,3-b]pyridine-5-carboxamide;4-chloro-N-(4-chlorophenyl)-3-methyl-1-[(5-methyl-3-pyridinyl)methyl]pyrazolo[3,4-b]pyridine-5-carboxamide;4-chloro-3-methyl-N-(4-methylphenyl)-1-[(5-methyl-3-pyridinyl)methyl]pyrazolo[3,4-b]pyridine-5-carboxamide;4-chloro-3-methyl-N-(4-propan-2-ylphenyl)-1-(pyridin-2-ylmethyl)pyrazolo[3,4-b]pyridine-5-carboxamide has a molecular weight of 2470.24 g/mol, XLogP of 32.95, 26 rotatable bonds, 6 hydrogen bond donors, and 24 hydrogen bond acceptors.
Where does this data come from?
All data for 1-benzyl-4-chloro-N-(4-chlorophenyl)-3-methylpyrrolo[2,3-b]pyridine-5-carboxamide;1-benzyl-4-chloro-3-methyl-N-(4-methylphenyl)pyrrolo[2,3-b]pyridine-5-carboxamide;1-benzyl-4-chloro-3-methyl-N-(4-propan-2-ylphenyl)pyrrolo[2,3-b]pyridine-5-carboxamide;4-chloro-N-(4-chlorophenyl)-3-methyl-1-[(5-methyl-3-pyridinyl)methyl]pyrazolo[3,4-b]pyridine-5-carboxamide;4-chloro-3-methyl-N-(4-methylphenyl)-1-[(5-methyl-3-pyridinyl)methyl]pyrazolo[3,4-b]pyridine-5-carboxamide;4-chloro-3-methyl-N-(4-propan-2-ylphenyl)-1-(pyridin-2-ylmethyl)pyrazolo[3,4-b]pyridine-5-carboxamide is sourced from PubChem (CID 158845151), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).