4-chloro-N-(4-chlorophenyl)-1-[[6-(1,1-difluoroethyl)-3-pyridinyl]methyl]-3-methylpyrazolo[3,4-b]pyridine-5-carboxamide;4-chloro-N-(4-chlorophenyl)-1-[(5-methoxy-3-pyridinyl)methyl]-3-methylpyrazolo[3,4-b]pyridine-5-carboxamide;4-chloro-N-(4-chlorophenyl)-3-methyl-1-[(6-methyl-2-pyridinyl)methyl]pyrazolo[3,4-b]pyridine-5-carboxamide;4-chloro-1-[[6-(1,1-difluoroethyl)-3-pyridinyl]methyl]-3-methyl-N-(4-methylphenyl)pyrazolo[3,4-b]pyridine-5-carboxamide;4-chloro-1-[(5-methoxy-3-pyridinyl)methyl]-3-methyl-N-(4-methylphenyl)pyrazolo[3,4-b]pyridine-5-carboxamide;4-chloro-3-methyl-1-[(6-methyl-2-pyridinyl)methyl]-N-[4-(trifluoromethyl)phenyl]pyrazolo[3,4-b]pyridine-5-carboxamide

C131H108Cl9F7N30O8 — CID 160927558

IUPAC4-chloro-N-(4-chlorophenyl)-1-[[6-(1,1-difluoroethyl)-3-pyridinyl]methyl]-3-methylpyrazolo[3,4-b]pyridine-5-carboxamide;4-chloro-N-(4-chlorophenyl)-1-[(5-methoxy-3-pyridinyl)methyl]-3-methylpyrazolo[3,4-b]pyridine-5-carboxamide;4-chloro-N-(4-chlorophenyl)-3-methyl-1-[(6-methyl-2-pyridinyl)methyl]pyrazolo[3,4-b]pyridine-5-carboxamide;4-chloro-1-[[6-(1,1-difluoroethyl)-3-pyridinyl]methyl]-3-methyl-N-(4-methylphenyl)pyrazolo[3,4-b]pyridine-5-carboxamide;4-chloro-1-[(5-methoxy-3-pyridinyl)methyl]-3-methyl-N-(4-methylphenyl)pyrazolo[3,4-b]pyridine-5-carboxamide;4-chloro-3-methyl-1-[(6-methyl-2-pyridinyl)methyl]-N-[4-(trifluoromethyl)phenyl]pyrazolo[3,4-b]pyridine-5-carboxamide
SMILESCOc1cncc(Cn2nc(C)c3c(Cl)c(C(=O)Nc4ccc(C)cc4)cnc32)c1.COc1cncc(Cn2nc(C)c3c(Cl)c(C(=O)Nc4ccc(Cl)cc4)cnc32)c1.Cc1ccc(NC(=O)c2cnc3c(c(C)nn3Cc3ccc(C(C)(F)F)nc3)c2Cl)cc1.Cc1cccc(Cn2nc(C)c3c(Cl)c(C(=O)Nc4ccc(C(F)(F)F)cc4)cnc32)n1.Cc1cccc(Cn2nc(C)c3c(Cl)c(C(=O)Nc4ccc(Cl)cc4)cnc32)n1.Cc1nn(Cc2ccc(C(C)(F)F)nc2)c2ncc(C(=O)Nc3ccc(Cl)cc3)c(Cl)c12
InChIInChI=1S/C23H20ClF2N5O.C22H17Cl2F2N5O.C22H17ClF3N5O.C22H20ClN5O2.C21H17Cl2N5O2.C21H17Cl2N5O/c1-13-4-7-16(8-5-13)29-22(32)17-11-28-21-19(20(17)24)14(2)30-31(21)12-15-6-9-18(27-10-15)23(3,25)26;1-12-18-19(24)16(21(32)29-15-6-4-14(23)5-7-15)10-28-20(18)31(30-12)11-13-3-8-17(27-9-13)22(2,25)26;1-12-4-3-5-16(28-12)11-31-20-18(13(2)30-31)19(23)17(10-27-20)21(32)29-15-8-6-14(7-9-15)22(24,25)26;1-13-4-6-16(7-5-13)26-22(29)18-11-25-21-19(20(18)23)14(2)27-28(21)12-15-8-17(30-3)10-24-9-15;1-12-18-19(23)17(21(29)26-15-5-3-14(22)4-6-15)10-25-20(18)28(27-12)11-13-7-16(30-2)9-24-8-13;1-12-4-3-5-16(25-12)11-28-20-18(13(2)27-28)19(23)17(10-24-20)21(29)26-15-8-6-14(22)7-9-15/h4-11H,12H2,1-3H3,(H,29,32);2*3-10H,11H2,1-2H3,(H,29,32);4-11H,12H2,1-3H3,(H,26,29);3-10H,11H2,1-2H3,(H,26,29);3-10H,11H2,1-2H3,(H,26,29)
InChIKeySSVMVGRPYLZELL-UHFFFAOYSA-N
MW2682.57 g/mol
LogP30.99
Rot. Bonds28

About 4-chloro-N-(4-chlorophenyl)-1-[[6-(1,1-difluoroethyl)-3-pyridinyl]methyl]-3-methylpyrazolo[3,4-b]pyridine-5-carboxamide;4-chloro-N-(4-chlorophenyl)-1-[(5-methoxy-3-pyridinyl)methyl]-3-methylpyrazolo[3,4-b]pyridine-5-carboxamide;4-chloro-N-(4-chlorophenyl)-3-methyl-1-[(6-methyl-2-pyridinyl)methyl]pyrazolo[3,4-b]pyridine-5-carboxamide;4-chloro-1-[[6-(1,1-difluoroethyl)-3-pyridinyl]methyl]-3-methyl-N-(4-methylphenyl)pyrazolo[3,4-b]pyridine-5-carboxamide;4-chloro-1-[(5-methoxy-3-pyridinyl)methyl]-3-methyl-N-(4-methylphenyl)pyrazolo[3,4-b]pyridine-5-carboxamide;4-chloro-3-methyl-1-[(6-methyl-2-pyridinyl)methyl]-N-[4-(trifluoromethyl)phenyl]pyrazolo[3,4-b]pyridine-5-carboxamide

4-chloro-N-(4-chlorophenyl)-1-[[6-(1,1-difluoroethyl)-3-pyridinyl]methyl]-3-methylpyrazolo[3,4-b]pyridine-5-carboxamide;4-chloro-N-(4-chlorophenyl)-1-[(5-methoxy-3-pyridinyl)methyl]-3-methylpyrazolo[3,4-b]pyridine-5-carboxamide;4-chloro-N-(4-chlorophenyl)-3-methyl-1-[(6-methyl-2-pyridinyl)methyl]pyrazolo[3,4-b]pyridine-5-carboxamide;4-chloro-1-[[6-(1,1-difluoroethyl)-3-pyridinyl]methyl]-3-methyl-N-(4-methylphenyl)pyrazolo[3,4-b]pyridine-5-carboxamide;4-chloro-1-[(5-methoxy-3-pyridinyl)methyl]-3-methyl-N-(4-methylphenyl)pyrazolo[3,4-b]pyridine-5-carboxamide;4-chloro-3-methyl-1-[(6-methyl-2-pyridinyl)methyl]-N-[4-(trifluoromethyl)phenyl]pyrazolo[3,4-b]pyridine-5-carboxamide (PubChem CID 160927558) has the molecular formula C131H108Cl9F7N30O8 and a molecular weight of 2682.57 g/mol. Its IUPAC name is 4-chloro-N-(4-chlorophenyl)-1-[[6-(1,1-difluoroethyl)-3-pyridinyl]methyl]-3-methylpyrazolo[3,4-b]pyridine-5-carboxamide;4-chloro-N-(4-chlorophenyl)-1-[(5-methoxy-3-pyridinyl)methyl]-3-methylpyrazolo[3,4-b]pyridine-5-carboxamide;4-chloro-N-(4-chlorophenyl)-3-methyl-1-[(6-methyl-2-pyridinyl)methyl]pyrazolo[3,4-b]pyridine-5-carboxamide;4-chloro-1-[[6-(1,1-difluoroethyl)-3-pyridinyl]methyl]-3-methyl-N-(4-methylphenyl)pyrazolo[3,4-b]pyridine-5-carboxamide;4-chloro-1-[(5-methoxy-3-pyridinyl)methyl]-3-methyl-N-(4-methylphenyl)pyrazolo[3,4-b]pyridine-5-carboxamide;4-chloro-3-methyl-1-[(6-methyl-2-pyridinyl)methyl]-N-[4-(trifluoromethyl)phenyl]pyrazolo[3,4-b]pyridine-5-carboxamide.

Molecular Properties

Compound Name4-chloro-N-(4-chlorophenyl)-1-[[6-(1,1-difluoroethyl)-3-pyridinyl]methyl]-3-methylpyrazolo[3,4-b]pyridine-5-carboxamide;4-chloro-N-(4-chlorophenyl)-1-[(5-methoxy-3-pyridinyl)methyl]-3-methylpyrazolo[3,4-b]pyridine-5-carboxamide;4-chloro-N-(4-chlorophenyl)-3-methyl-1-[(6-methyl-2-pyridinyl)methyl]pyrazolo[3,4-b]pyridine-5-carboxamide;4-chloro-1-[[6-(1,1-difluoroethyl)-3-pyridinyl]methyl]-3-methyl-N-(4-methylphenyl)pyrazolo[3,4-b]pyridine-5-carboxamide;4-chloro-1-[(5-methoxy-3-pyridinyl)methyl]-3-methyl-N-(4-methylphenyl)pyrazolo[3,4-b]pyridine-5-carboxamide;4-chloro-3-methyl-1-[(6-methyl-2-pyridinyl)methyl]-N-[4-(trifluoromethyl)phenyl]pyrazolo[3,4-b]pyridine-5-carboxamide
PubChem CID160927558
Molecular FormulaC131H108Cl9F7N30O8
Molecular Weight2682.57 g/mol
Exact Mass2676.61
IUPAC Name4-chloro-N-(4-chlorophenyl)-1-[[6-(1,1-difluoroethyl)-3-pyridinyl]methyl]-3-methylpyrazolo[3,4-b]pyridine-5-carboxamide;4-chloro-N-(4-chlorophenyl)-1-[(5-methoxy-3-pyridinyl)methyl]-3-methylpyrazolo[3,4-b]pyridine-5-carboxamide;4-chloro-N-(4-chlorophenyl)-3-methyl-1-[(6-methyl-2-pyridinyl)methyl]pyrazolo[3,4-b]pyridine-5-carboxamide;4-chloro-1-[[6-(1,1-difluoroethyl)-3-pyridinyl]methyl]-3-methyl-N-(4-methylphenyl)pyrazolo[3,4-b]pyridine-5-carboxamide;4-chloro-1-[(5-methoxy-3-pyridinyl)methyl]-3-methyl-N-(4-methylphenyl)pyrazolo[3,4-b]pyridine-5-carboxamide;4-chloro-3-methyl-1-[(6-methyl-2-pyridinyl)methyl]-N-[4-(trifluoromethyl)phenyl]pyrazolo[3,4-b]pyridine-5-carboxamide
SMILESCOc1cncc(Cn2nc(C)c3c(Cl)c(C(=O)Nc4ccc(C)cc4)cnc32)c1.COc1cncc(Cn2nc(C)c3c(Cl)c(C(=O)Nc4ccc(Cl)cc4)cnc32)c1.Cc1ccc(NC(=O)c2cnc3c(c(C)nn3Cc3ccc(C(C)(F)F)nc3)c2Cl)cc1.Cc1cccc(Cn2nc(C)c3c(Cl)c(C(=O)Nc4ccc(C(F)(F)F)cc4)cnc32)n1.Cc1cccc(Cn2nc(C)c3c(Cl)c(C(=O)Nc4ccc(Cl)cc4)cnc32)n1.Cc1nn(Cc2ccc(C(C)(F)F)nc2)c2ncc(C(=O)Nc3ccc(Cl)cc3)c(Cl)c12
InChIInChI=1S/C23H20ClF2N5O.C22H17Cl2F2N5O.C22H17ClF3N5O.C22H20ClN5O2.C21H17Cl2N5O2.C21H17Cl2N5O/c1-13-4-7-16(8-5-13)29-22(32)17-11-28-21-19(20(17)24)14(2)30-31(21)12-15-6-9-18(27-10-15)23(3,25)26;1-12-18-19(24)16(21(32)29-15-6-4-14(23)5-7-15)10-28-20(18)31(30-12)11-13-3-8-17(27-9-13)22(2,25)26;1-12-4-3-5-16(28-12)11-31-20-18(13(2)30-31)19(23)17(10-27-20)21(32)29-15-8-6-14(7-9-15)22(24,25)26;1-13-4-6-16(7-5-13)26-22(29)18-11-25-21-19(20(18)23)14(2)27-28(21)12-15-8-17(30-3)10-24-9-15;1-12-18-19(23)17(21(29)26-15-5-3-14(22)4-6-15)10-25-20(18)28(27-12)11-13-7-16(30-2)9-24-8-13;1-12-4-3-5-16(25-12)11-28-20-18(13(2)27-28)19(23)17(10-24-20)21(29)26-15-8-6-14(22)7-9-15/h4-11H,12H2,1-3H3,(H,29,32);2*3-10H,11H2,1-2H3,(H,29,32);4-11H,12H2,1-3H3,(H,26,29);3-10H,11H2,1-2H3,(H,26,29);3-10H,11H2,1-2H3,(H,26,29)
InChIKeySSVMVGRPYLZELL-UHFFFAOYSA-N
XLogP30.99
TPSA454.66 Ų
H-Bond Donors6
H-Bond Acceptors32
Rotatable Bonds28
Heavy Atoms185
Complexity—

Lipinski Rule of Five

4 violations

RuleValue
MW ≤ 5002682.57
LogP ≤ 530.99
H-Bond Donors ≤ 56
H-Bond Acceptors ≤ 1032

Analyze 4-chloro-N-(4-chlorophenyl)-1-[[6-(1,1-difluoroethyl)-3-pyridinyl]methyl]-3-methylpyrazolo[3,4-b]pyridine-5-carboxamide;4-chloro-N-(4-chlorophenyl)-1-[(5-methoxy-3-pyridinyl)methyl]-3-methylpyrazolo[3,4-b]pyridine-5-carboxamide;4-chloro-N-(4-chlorophenyl)-3-methyl-1-[(6-methyl-2-pyridinyl)methyl]pyrazolo[3,4-b]pyridine-5-carboxamide;4-chloro-1-[[6-(1,1-difluoroethyl)-3-pyridinyl]methyl]-3-methyl-N-(4-methylphenyl)pyrazolo[3,4-b]pyridine-5-carboxamide;4-chloro-1-[(5-methoxy-3-pyridinyl)methyl]-3-methyl-N-(4-methylphenyl)pyrazolo[3,4-b]pyridine-5-carboxamide;4-chloro-3-methyl-1-[(6-methyl-2-pyridinyl)methyl]-N-[4-(trifluoromethyl)phenyl]pyrazolo[3,4-b]pyridine-5-carboxamide with MolForge

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Related Compounds

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US10272074, Example 248
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6-anilino-4-chloro-5-ethanimidoyl-N-phenylpyridine-3-carboxamide;4-chloro-N-[4-(2-methoxyethyl)phenyl]-3-methyl-1-phenylpyrazolo[3,4-b]pyridine-5-carboxamide;4-chloro-3-methyl-1-phenyl-N-[4-(trifluoromethoxy)phenyl]pyrazolo[3,4-b]pyridine-5-carboxamide;ethane
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4-chloro-N-(4-chlorophenyl)-3-methyl-1-(oxan-4-yl)pyrazolo[3,4-b]pyridine-5-carboxamide;4-chloro-1-cyclopentyl-3-methyl-N-(4-propan-2-ylphenyl)pyrazolo[3,4-b]pyridine-5-carboxamide;4-chloro-1-cyclopentyl-3-methyl-N-[4-(trifluoromethyl)phenyl]pyrazolo[3,4-b]pyridine-5-carboxamide;4-chloro-3-methyl-N-(4-methylphenyl)-1-(oxan-4-yl)pyrazolo[3,4-b]pyridine-5-carboxamide;4-chloro-3-methyl-1-(oxan-4-yl)-N-(4-propan-2-ylphenyl)pyrazolo[3,4-b]pyridine-5-carboxamide;N-(4-chlorophenyl)-4-methoxy-3-methyl-1-(oxan-4-yl)pyrazolo[3,4-b]pyridine-5-carboxamide
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4-chloro-N-(4-chlorophenyl)-3-methyl-1-[(5-methyl-2H-triazol-4-yl)methyl]pyrazolo[3,4-b]pyridine-5-carboxamide;4-chloro-N-(4-methoxyphenyl)-3-methyl-1-[(5-methyl-4H-pyrazol-3-yl)methyl]pyrazolo[3,4-b]pyridine-5-carboxamide;4-chloro-1-[[1-[(4-methoxyphenyl)methyl]-5-methyltriazol-4-yl]methyl]-3-methyl-N-[4-(trifluoromethyl)phenyl]pyrazolo[3,4-b]pyridine-5-carboxamide;4-chloro-N-(4-methoxyphenyl)-3-methyl-1-[(5-methyl-2H-triazol-4-yl)methyl]pyrazolo[3,4-b]pyridine-5-carboxamide;4-chloro-3-methyl-1-[(5-methyl-2H-triazol-4-yl)methyl]-N-[4-(trifluoromethyl)phenyl]pyrazolo[3,4-b]pyridine-5-carboxamide;methane
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4-chloro-N-(4-chlorophenyl)-1-(1-ethylpiperidin-4-yl)-3-methylpyrazolo[3,4-b]pyridine-5-carboxamide;4-chloro-N-(4-chlorophenyl)-3-methyl-1-(1-propan-2-ylpiperidin-4-yl)pyrazolo[3,4-b]pyridine-5-carboxamide;4-chloro-1-(1-ethylpiperidin-4-yl)-3-methyl-N-(4-methylphenyl)pyrazolo[3,4-b]pyridine-5-carboxamide;4-chloro-3-methyl-N-(4-methylphenyl)-1-(1-propan-2-ylpiperidin-4-yl)pyrazolo[3,4-b]pyridine-5-carboxamide;4-chloro-3-methyl-1-(1-methylpiperidin-4-yl)-N-[4-(trifluoromethyl)phenyl]pyrazolo[3,4-b]pyridine-5-carboxamide
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Frequently Asked Questions

What is the IUPAC name of 4-chloro-N-(4-chlorophenyl)-1-[[6-(1,1-difluoroethyl)-3-pyridinyl]methyl]-3-methylpyrazolo[3,4-b]pyridine-5-carboxamide;4-chloro-N-(4-chlorophenyl)-1-[(5-methoxy-3-pyridinyl)methyl]-3-methylpyrazolo[3,4-b]pyridine-5-carboxamide;4-chloro-N-(4-chlorophenyl)-3-methyl-1-[(6-methyl-2-pyridinyl)methyl]pyrazolo[3,4-b]pyridine-5-carboxamide;4-chloro-1-[[6-(1,1-difluoroethyl)-3-pyridinyl]methyl]-3-methyl-N-(4-methylphenyl)pyrazolo[3,4-b]pyridine-5-carboxamide;4-chloro-1-[(5-methoxy-3-pyridinyl)methyl]-3-methyl-N-(4-methylphenyl)pyrazolo[3,4-b]pyridine-5-carboxamide;4-chloro-3-methyl-1-[(6-methyl-2-pyridinyl)methyl]-N-[4-(trifluoromethyl)phenyl]pyrazolo[3,4-b]pyridine-5-carboxamide?
The IUPAC name of 4-chloro-N-(4-chlorophenyl)-1-[[6-(1,1-difluoroethyl)-3-pyridinyl]methyl]-3-methylpyrazolo[3,4-b]pyridine-5-carboxamide;4-chloro-N-(4-chlorophenyl)-1-[(5-methoxy-3-pyridinyl)methyl]-3-methylpyrazolo[3,4-b]pyridine-5-carboxamide;4-chloro-N-(4-chlorophenyl)-3-methyl-1-[(6-methyl-2-pyridinyl)methyl]pyrazolo[3,4-b]pyridine-5-carboxamide;4-chloro-1-[[6-(1,1-difluoroethyl)-3-pyridinyl]methyl]-3-methyl-N-(4-methylphenyl)pyrazolo[3,4-b]pyridine-5-carboxamide;4-chloro-1-[(5-methoxy-3-pyridinyl)methyl]-3-methyl-N-(4-methylphenyl)pyrazolo[3,4-b]pyridine-5-carboxamide;4-chloro-3-methyl-1-[(6-methyl-2-pyridinyl)methyl]-N-[4-(trifluoromethyl)phenyl]pyrazolo[3,4-b]pyridine-5-carboxamide (CID 160927558) is 4-chloro-N-(4-chlorophenyl)-1-[[6-(1,1-difluoroethyl)-3-pyridinyl]methyl]-3-methylpyrazolo[3,4-b]pyridine-5-carboxamide;4-chloro-N-(4-chlorophenyl)-1-[(5-methoxy-3-pyridinyl)methyl]-3-methylpyrazolo[3,4-b]pyridine-5-carboxamide;4-chloro-N-(4-chlorophenyl)-3-methyl-1-[(6-methyl-2-pyridinyl)methyl]pyrazolo[3,4-b]pyridine-5-carboxamide;4-chloro-1-[[6-(1,1-difluoroethyl)-3-pyridinyl]methyl]-3-methyl-N-(4-methylphenyl)pyrazolo[3,4-b]pyridine-5-carboxamide;4-chloro-1-[(5-methoxy-3-pyridinyl)methyl]-3-methyl-N-(4-methylphenyl)pyrazolo[3,4-b]pyridine-5-carboxamide;4-chloro-3-methyl-1-[(6-methyl-2-pyridinyl)methyl]-N-[4-(trifluoromethyl)phenyl]pyrazolo[3,4-b]pyridine-5-carboxamide.
What is the SMILES notation for 4-chloro-N-(4-chlorophenyl)-1-[[6-(1,1-difluoroethyl)-3-pyridinyl]methyl]-3-methylpyrazolo[3,4-b]pyridine-5-carboxamide;4-chloro-N-(4-chlorophenyl)-1-[(5-methoxy-3-pyridinyl)methyl]-3-methylpyrazolo[3,4-b]pyridine-5-carboxamide;4-chloro-N-(4-chlorophenyl)-3-methyl-1-[(6-methyl-2-pyridinyl)methyl]pyrazolo[3,4-b]pyridine-5-carboxamide;4-chloro-1-[[6-(1,1-difluoroethyl)-3-pyridinyl]methyl]-3-methyl-N-(4-methylphenyl)pyrazolo[3,4-b]pyridine-5-carboxamide;4-chloro-1-[(5-methoxy-3-pyridinyl)methyl]-3-methyl-N-(4-methylphenyl)pyrazolo[3,4-b]pyridine-5-carboxamide;4-chloro-3-methyl-1-[(6-methyl-2-pyridinyl)methyl]-N-[4-(trifluoromethyl)phenyl]pyrazolo[3,4-b]pyridine-5-carboxamide?
The canonical SMILES for 4-chloro-N-(4-chlorophenyl)-1-[[6-(1,1-difluoroethyl)-3-pyridinyl]methyl]-3-methylpyrazolo[3,4-b]pyridine-5-carboxamide;4-chloro-N-(4-chlorophenyl)-1-[(5-methoxy-3-pyridinyl)methyl]-3-methylpyrazolo[3,4-b]pyridine-5-carboxamide;4-chloro-N-(4-chlorophenyl)-3-methyl-1-[(6-methyl-2-pyridinyl)methyl]pyrazolo[3,4-b]pyridine-5-carboxamide;4-chloro-1-[[6-(1,1-difluoroethyl)-3-pyridinyl]methyl]-3-methyl-N-(4-methylphenyl)pyrazolo[3,4-b]pyridine-5-carboxamide;4-chloro-1-[(5-methoxy-3-pyridinyl)methyl]-3-methyl-N-(4-methylphenyl)pyrazolo[3,4-b]pyridine-5-carboxamide;4-chloro-3-methyl-1-[(6-methyl-2-pyridinyl)methyl]-N-[4-(trifluoromethyl)phenyl]pyrazolo[3,4-b]pyridine-5-carboxamide is COc1cncc(Cn2nc(C)c3c(Cl)c(C(=O)Nc4ccc(C)cc4)cnc32)c1.COc1cncc(Cn2nc(C)c3c(Cl)c(C(=O)Nc4ccc(Cl)cc4)cnc32)c1.Cc1ccc(NC(=O)c2cnc3c(c(C)nn3Cc3ccc(C(C)(F)F)nc3)c2Cl)cc1.Cc1cccc(Cn2nc(C)c3c(Cl)c(C(=O)Nc4ccc(C(F)(F)F)cc4)cnc32)n1.Cc1cccc(Cn2nc(C)c3c(Cl)c(C(=O)Nc4ccc(Cl)cc4)cnc32)n1.Cc1nn(Cc2ccc(C(C)(F)F)nc2)c2ncc(C(=O)Nc3ccc(Cl)cc3)c(Cl)c12.
What is the InChIKey of 4-chloro-N-(4-chlorophenyl)-1-[[6-(1,1-difluoroethyl)-3-pyridinyl]methyl]-3-methylpyrazolo[3,4-b]pyridine-5-carboxamide;4-chloro-N-(4-chlorophenyl)-1-[(5-methoxy-3-pyridinyl)methyl]-3-methylpyrazolo[3,4-b]pyridine-5-carboxamide;4-chloro-N-(4-chlorophenyl)-3-methyl-1-[(6-methyl-2-pyridinyl)methyl]pyrazolo[3,4-b]pyridine-5-carboxamide;4-chloro-1-[[6-(1,1-difluoroethyl)-3-pyridinyl]methyl]-3-methyl-N-(4-methylphenyl)pyrazolo[3,4-b]pyridine-5-carboxamide;4-chloro-1-[(5-methoxy-3-pyridinyl)methyl]-3-methyl-N-(4-methylphenyl)pyrazolo[3,4-b]pyridine-5-carboxamide;4-chloro-3-methyl-1-[(6-methyl-2-pyridinyl)methyl]-N-[4-(trifluoromethyl)phenyl]pyrazolo[3,4-b]pyridine-5-carboxamide?
The InChIKey is SSVMVGRPYLZELL-UHFFFAOYSA-N. The full InChI is InChI=1S/C23H20ClF2N5O.C22H17Cl2F2N5O.C22H17ClF3N5O.C22H20ClN5O2.C21H17Cl2N5O2.C21H17Cl2N5O/c1-13-4-7-16(8-5-13)29-22(32)17-11-28-21-19(20(17)24)14(2)30-31(21)12-15-6-9-18(27-10-15)23(3,25)26;1-12-18-19(24)16(21(32)29-15-6-4-14(23)5-7-15)10-28-20(18)31(30-12)11-13-3-8-17(27-9-13)22(2,25)26;1-12-4-3-5-16(28-12)11-31-20-18(13(2)30-31)19(23)17(10-27-20)21(32)29-15-8-6-14(7-9-15)22(24,25)26;1-13-4-6-16(7-5-13)26-22(29)18-11-25-21-19(20(18)23)14(2)27-28(21)12-15-8-17(30-3)10-24-9-15;1-12-18-19(23)17(21(29)26-15-5-3-14(22)4-6-15)10-25-20(18)28(27-12)11-13-7-16(30-2)9-24-8-13;1-12-4-3-5-16(25-12)11-28-20-18(13(2)27-28)19(23)17(10-24-20)21(29)26-15-8-6-14(22)7-9-15/h4-11H,12H2,1-3H3,(H,29,32);2*3-10H,11H2,1-2H3,(H,29,32);4-11H,12H2,1-3H3,(H,26,29);3-10H,11H2,1-2H3,(H,26,29);3-10H,11H2,1-2H3,(H,26,29).
What are the key properties of 4-chloro-N-(4-chlorophenyl)-1-[[6-(1,1-difluoroethyl)-3-pyridinyl]methyl]-3-methylpyrazolo[3,4-b]pyridine-5-carboxamide;4-chloro-N-(4-chlorophenyl)-1-[(5-methoxy-3-pyridinyl)methyl]-3-methylpyrazolo[3,4-b]pyridine-5-carboxamide;4-chloro-N-(4-chlorophenyl)-3-methyl-1-[(6-methyl-2-pyridinyl)methyl]pyrazolo[3,4-b]pyridine-5-carboxamide;4-chloro-1-[[6-(1,1-difluoroethyl)-3-pyridinyl]methyl]-3-methyl-N-(4-methylphenyl)pyrazolo[3,4-b]pyridine-5-carboxamide;4-chloro-1-[(5-methoxy-3-pyridinyl)methyl]-3-methyl-N-(4-methylphenyl)pyrazolo[3,4-b]pyridine-5-carboxamide;4-chloro-3-methyl-1-[(6-methyl-2-pyridinyl)methyl]-N-[4-(trifluoromethyl)phenyl]pyrazolo[3,4-b]pyridine-5-carboxamide?
4-chloro-N-(4-chlorophenyl)-1-[[6-(1,1-difluoroethyl)-3-pyridinyl]methyl]-3-methylpyrazolo[3,4-b]pyridine-5-carboxamide;4-chloro-N-(4-chlorophenyl)-1-[(5-methoxy-3-pyridinyl)methyl]-3-methylpyrazolo[3,4-b]pyridine-5-carboxamide;4-chloro-N-(4-chlorophenyl)-3-methyl-1-[(6-methyl-2-pyridinyl)methyl]pyrazolo[3,4-b]pyridine-5-carboxamide;4-chloro-1-[[6-(1,1-difluoroethyl)-3-pyridinyl]methyl]-3-methyl-N-(4-methylphenyl)pyrazolo[3,4-b]pyridine-5-carboxamide;4-chloro-1-[(5-methoxy-3-pyridinyl)methyl]-3-methyl-N-(4-methylphenyl)pyrazolo[3,4-b]pyridine-5-carboxamide;4-chloro-3-methyl-1-[(6-methyl-2-pyridinyl)methyl]-N-[4-(trifluoromethyl)phenyl]pyrazolo[3,4-b]pyridine-5-carboxamide has a molecular weight of 2682.57 g/mol, XLogP of 30.99, 28 rotatable bonds, 6 hydrogen bond donors, and 32 hydrogen bond acceptors.
Where does this data come from?
All data for 4-chloro-N-(4-chlorophenyl)-1-[[6-(1,1-difluoroethyl)-3-pyridinyl]methyl]-3-methylpyrazolo[3,4-b]pyridine-5-carboxamide;4-chloro-N-(4-chlorophenyl)-1-[(5-methoxy-3-pyridinyl)methyl]-3-methylpyrazolo[3,4-b]pyridine-5-carboxamide;4-chloro-N-(4-chlorophenyl)-3-methyl-1-[(6-methyl-2-pyridinyl)methyl]pyrazolo[3,4-b]pyridine-5-carboxamide;4-chloro-1-[[6-(1,1-difluoroethyl)-3-pyridinyl]methyl]-3-methyl-N-(4-methylphenyl)pyrazolo[3,4-b]pyridine-5-carboxamide;4-chloro-1-[(5-methoxy-3-pyridinyl)methyl]-3-methyl-N-(4-methylphenyl)pyrazolo[3,4-b]pyridine-5-carboxamide;4-chloro-3-methyl-1-[(6-methyl-2-pyridinyl)methyl]-N-[4-(trifluoromethyl)phenyl]pyrazolo[3,4-b]pyridine-5-carboxamide is sourced from PubChem (CID 160927558), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).