1-(4-chlorophenyl)-N-[[4-(3-hydroxypyrrolidin-1-yl)sulfonylphenyl]methyl]pyrazolo[5,4-c]pyridine-4-carboxamide;1-(4-chlorophenyl)-N-[(3-methylsulfonylphenyl)methyl]pyrazolo[5,4-c]pyridine-4-carboxamide;1-(4-chlorophenyl)-N-[1-(6-methylsulfonyl-3-pyridinyl)butyl]pyrazolo[5,4-c]pyridine-4-carboxamide;1-(4-chlorophenyl)-N-[(6-morpholin-4-ylsulfonyl-3-pyridinyl)methyl]pyrazolo[5,4-c]pyridine-4-carboxamide;methyl 3-[[6-[[[1-(4-fluorophenyl)pyrazolo[5,4-c]pyridine-4-carbonyl]amino]methyl]-2-pyridinyl]sulfonyl]propanoate

C114H102Cl4FN25O19S5 — CID 159673020

About 1-(4-chlorophenyl)-N-[[4-(3-hydroxypyrrolidin-1-yl)sulfonylphenyl]methyl]pyrazolo[5,4-c]pyridine-4-carboxamide;1-(4-chlorophenyl)-N-[(3-methylsulfonylphenyl)methyl]pyrazolo[5,4-c]pyridine-4-carboxamide;1-(4-chlorophenyl)-N-[1-(6-methylsulfonyl-3-pyridinyl)butyl]pyrazolo[5,4-c]pyridine-4-carboxamide;1-(4-chlorophenyl)-N-[(6-morpholin-4-ylsulfonyl-3-pyridinyl)methyl]pyrazolo[5,4-c]pyridine-4-carboxamide;methyl 3-[[6-[[[1-(4-fluorophenyl)pyrazolo[5,4-c]pyridine-4-carbonyl]amino]methyl]-2-pyridinyl]sulfonyl]propanoate

1-(4-chlorophenyl)-N-[[4-(3-hydroxypyrrolidin-1-yl)sulfonylphenyl]methyl]pyrazolo[5,4-c]pyridine-4-carboxamide;1-(4-chlorophenyl)-N-[(3-methylsulfonylphenyl)methyl]pyrazolo[5,4-c]pyridine-4-carboxamide;1-(4-chlorophenyl)-N-[1-(6-methylsulfonyl-3-pyridinyl)butyl]pyrazolo[5,4-c]pyridine-4-carboxamide;1-(4-chlorophenyl)-N-[(6-morpholin-4-ylsulfonyl-3-pyridinyl)methyl]pyrazolo[5,4-c]pyridine-4-carboxamide;methyl 3-[[6-[[[1-(4-fluorophenyl)pyrazolo[5,4-c]pyridine-4-carbonyl]amino]methyl]-2-pyridinyl]sulfonyl]propanoate (PubChem CID 159673020) has the molecular formula C114H102Cl4FN25O19S5 and a molecular weight of 2447.37 g/mol. Its IUPAC name is 1-(4-chlorophenyl)-N-[[4-(3-hydroxypyrrolidin-1-yl)sulfonylphenyl]methyl]pyrazolo[5,4-c]pyridine-4-carboxamide;1-(4-chlorophenyl)-N-[(3-methylsulfonylphenyl)methyl]pyrazolo[5,4-c]pyridine-4-carboxamide;1-(4-chlorophenyl)-N-[1-(6-methylsulfonyl-3-pyridinyl)butyl]pyrazolo[5,4-c]pyridine-4-carboxamide;1-(4-chlorophenyl)-N-[(6-morpholin-4-ylsulfonyl-3-pyridinyl)methyl]pyrazolo[5,4-c]pyridine-4-carboxamide;methyl 3-[[6-[[[1-(4-fluorophenyl)pyrazolo[5,4-c]pyridine-4-carbonyl]amino]methyl]-2-pyridinyl]sulfonyl]propanoate.

Molecular Properties

• Compound Name: 1-(4-chlorophenyl)-N-[[4-(3-hydroxypyrrolidin-1-yl)sulfonylphenyl]methyl]pyrazolo[5,4-c]pyridine-4-carboxamide;1-(4-chlorophenyl)-N-[(3-methylsulfonylphenyl)methyl]pyrazolo[5,4-c]pyridine-4-carboxamide;1-(4-chlorophenyl)-N-[1-(6-methylsulfonyl-3-pyridinyl)butyl]pyrazolo[5,4-c]pyridine-4-carboxamide;1-(4-chlorophenyl)-N-[(6-morpholin-4-ylsulfonyl-3-pyridinyl)methyl]pyrazolo[5,4-c]pyridine-4-carboxamide;methyl 3-[[6-[[[1-(4-fluorophenyl)pyrazolo[5,4-c]pyridine-4-carbonyl]amino]methyl]-2-pyridinyl]sulfonyl]propanoate
• PubChem CID: 159673020
• Molecular Formula: C114H102Cl4FN25O19S5
• Molecular Weight: 2447.37 g/mol
• Exact Mass: 2443.51
• IUPAC Name: 1-(4-chlorophenyl)-N-[[4-(3-hydroxypyrrolidin-1-yl)sulfonylphenyl]methyl]pyrazolo[5,4-c]pyridine-4-carboxamide;1-(4-chlorophenyl)-N-[(3-methylsulfonylphenyl)methyl]pyrazolo[5,4-c]pyridine-4-carboxamide;1-(4-chlorophenyl)-N-[1-(6-methylsulfonyl-3-pyridinyl)butyl]pyrazolo[5,4-c]pyridine-4-carboxamide;1-(4-chlorophenyl)-N-[(6-morpholin-4-ylsulfonyl-3-pyridinyl)methyl]pyrazolo[5,4-c]pyridine-4-carboxamide;methyl 3-[[6-[[[1-(4-fluorophenyl)pyrazolo[5,4-c]pyridine-4-carbonyl]amino]methyl]-2-pyridinyl]sulfonyl]propanoate
• SMILES: CCCC(NC(=O)c1cncc2c1cnn2-c1ccc(Cl)cc1)c1ccc(S(C)(=O)=O)nc1.COC(=O)CCS(=O)(=O)c1cccc(CNC(=O)c2cncc3c2cnn3-c2ccc(F)cc2)n1.CS(=O)(=O)c1cccc(CNC(=O)c2cncc3c2cnn3-c2ccc(Cl)cc2)c1.O=C(NCc1ccc(S(=O)(=O)N2CCC(O)C2)cc1)c1cncc2c1cnn2-c1ccc(Cl)cc1.O=C(NCc1ccc(S(=O)(=O)N2CCOCC2)nc1)c1cncc2c1cnn2-c1ccc(Cl)cc1
• InChI: InChI=1S/C24H22ClN5O4S.C23H21ClN6O4S.C23H22ClN5O3S.C23H20FN5O5S.C21H17ClN4O3S/c25-17-3-5-18(6-4-17)30-23-14-26-12-22(21(23)13-28-30)24(32)27-11-16-1-7-20(8-2-16)35(33,34)29-10-9-19(31)15-29;24-17-2-4-18(5-3-17)30-21-15-25-13-20(19(21)14-28-30)23(31)27-12-16-1-6-22(26-11-16)35(32,33)29-7-9-34-10-8-29;1-3-4-20(15-5-10-22(26-11-15)33(2,31)32)28-23(30)19-12-25-14-21-18(19)13-27-29(21)17-8-6-16(24)7-9-17;1-34-22(30)9-10-35(32,33)21-4-2-3-16(28-21)11-26-23(31)19-12-25-14-20-18(19)13-27-29(20)17-7-5-15(24)6-8-17;1-30(28,29)17-4-2-3-14(9-17)10-24-21(27)19-11-23-13-20-18(19)12-25-26(20)16-7-5-15(22)6-8-16/h1-8,12-14,19,31H,9-11,15H2,(H,27,32);1-6,11,13-15H,7-10,12H2,(H,27,31);5-14,20H,3-4H2,1-2H3,(H,28,30);2-8,12-14H,9-11H2,1H3,(H,26,31);2-9,11-13H,10H2,1H3,(H,24,27)
• InChIKey: MUFVGCRTEXIEPD-UHFFFAOYSA-N
• XLogP: 14.95
• TPSA: 570.66 Ų
• H-Bond Donors: 6
• H-Bond Acceptors: 37
• Rotatable Bonds: 32
• Heavy Atoms: 168
• Complexity: —

Lipinski Rule of Five

4 violations

Rule	Value
MW ≤ 500	2447.37
LogP ≤ 5	14.95
H-Bond Donors ≤ 5	6
H-Bond Acceptors ≤ 10	37

Frequently Asked Questions

What is the IUPAC name of 1-(4-chlorophenyl)-N-[[4-(3-hydroxypyrrolidin-1-yl)sulfonylphenyl]methyl]pyrazolo[5,4-c]pyridine-4-carboxamide;1-(4-chlorophenyl)-N-[(3-methylsulfonylphenyl)methyl]pyrazolo[5,4-c]pyridine-4-carboxamide;1-(4-chlorophenyl)-N-[1-(6-methylsulfonyl-3-pyridinyl)butyl]pyrazolo[5,4-c]pyridine-4-carboxamide;1-(4-chlorophenyl)-N-[(6-morpholin-4-ylsulfonyl-3-pyridinyl)methyl]pyrazolo[5,4-c]pyridine-4-carboxamide;methyl 3-[[6-[[[1-(4-fluorophenyl)pyrazolo[5,4-c]pyridine-4-carbonyl]amino]methyl]-2-pyridinyl]sulfonyl]propanoate?

The IUPAC name of 1-(4-chlorophenyl)-N-[[4-(3-hydroxypyrrolidin-1-yl)sulfonylphenyl]methyl]pyrazolo[5,4-c]pyridine-4-carboxamide;1-(4-chlorophenyl)-N-[(3-methylsulfonylphenyl)methyl]pyrazolo[5,4-c]pyridine-4-carboxamide;1-(4-chlorophenyl)-N-[1-(6-methylsulfonyl-3-pyridinyl)butyl]pyrazolo[5,4-c]pyridine-4-carboxamide;1-(4-chlorophenyl)-N-[(6-morpholin-4-ylsulfonyl-3-pyridinyl)methyl]pyrazolo[5,4-c]pyridine-4-carboxamide;methyl 3-[[6-[[[1-(4-fluorophenyl)pyrazolo[5,4-c]pyridine-4-carbonyl]amino]methyl]-2-pyridinyl]sulfonyl]propanoate (CID 159673020) is 1-(4-chlorophenyl)-N-[[4-(3-hydroxypyrrolidin-1-yl)sulfonylphenyl]methyl]pyrazolo[5,4-c]pyridine-4-carboxamide;1-(4-chlorophenyl)-N-[(3-methylsulfonylphenyl)methyl]pyrazolo[5,4-c]pyridine-4-carboxamide;1-(4-chlorophenyl)-N-[1-(6-methylsulfonyl-3-pyridinyl)butyl]pyrazolo[5,4-c]pyridine-4-carboxamide;1-(4-chlorophenyl)-N-[(6-morpholin-4-ylsulfonyl-3-pyridinyl)methyl]pyrazolo[5,4-c]pyridine-4-carboxamide;methyl 3-[[6-[[[1-(4-fluorophenyl)pyrazolo[5,4-c]pyridine-4-carbonyl]amino]methyl]-2-pyridinyl]sulfonyl]propanoate.

What is the SMILES notation for 1-(4-chlorophenyl)-N-[[4-(3-hydroxypyrrolidin-1-yl)sulfonylphenyl]methyl]pyrazolo[5,4-c]pyridine-4-carboxamide;1-(4-chlorophenyl)-N-[(3-methylsulfonylphenyl)methyl]pyrazolo[5,4-c]pyridine-4-carboxamide;1-(4-chlorophenyl)-N-[1-(6-methylsulfonyl-3-pyridinyl)butyl]pyrazolo[5,4-c]pyridine-4-carboxamide;1-(4-chlorophenyl)-N-[(6-morpholin-4-ylsulfonyl-3-pyridinyl)methyl]pyrazolo[5,4-c]pyridine-4-carboxamide;methyl 3-[[6-[[[1-(4-fluorophenyl)pyrazolo[5,4-c]pyridine-4-carbonyl]amino]methyl]-2-pyridinyl]sulfonyl]propanoate?

The canonical SMILES for 1-(4-chlorophenyl)-N-[[4-(3-hydroxypyrrolidin-1-yl)sulfonylphenyl]methyl]pyrazolo[5,4-c]pyridine-4-carboxamide;1-(4-chlorophenyl)-N-[(3-methylsulfonylphenyl)methyl]pyrazolo[5,4-c]pyridine-4-carboxamide;1-(4-chlorophenyl)-N-[1-(6-methylsulfonyl-3-pyridinyl)butyl]pyrazolo[5,4-c]pyridine-4-carboxamide;1-(4-chlorophenyl)-N-[(6-morpholin-4-ylsulfonyl-3-pyridinyl)methyl]pyrazolo[5,4-c]pyridine-4-carboxamide;methyl 3-[[6-[[[1-(4-fluorophenyl)pyrazolo[5,4-c]pyridine-4-carbonyl]amino]methyl]-2-pyridinyl]sulfonyl]propanoate is CCCC(NC(=O)c1cncc2c1cnn2-c1ccc(Cl)cc1)c1ccc(S(C)(=O)=O)nc1.COC(=O)CCS(=O)(=O)c1cccc(CNC(=O)c2cncc3c2cnn3-c2ccc(F)cc2)n1.CS(=O)(=O)c1cccc(CNC(=O)c2cncc3c2cnn3-c2ccc(Cl)cc2)c1.O=C(NCc1ccc(S(=O)(=O)N2CCC(O)C2)cc1)c1cncc2c1cnn2-c1ccc(Cl)cc1.O=C(NCc1ccc(S(=O)(=O)N2CCOCC2)nc1)c1cncc2c1cnn2-c1ccc(Cl)cc1.

What is the InChIKey of 1-(4-chlorophenyl)-N-[[4-(3-hydroxypyrrolidin-1-yl)sulfonylphenyl]methyl]pyrazolo[5,4-c]pyridine-4-carboxamide;1-(4-chlorophenyl)-N-[(3-methylsulfonylphenyl)methyl]pyrazolo[5,4-c]pyridine-4-carboxamide;1-(4-chlorophenyl)-N-[1-(6-methylsulfonyl-3-pyridinyl)butyl]pyrazolo[5,4-c]pyridine-4-carboxamide;1-(4-chlorophenyl)-N-[(6-morpholin-4-ylsulfonyl-3-pyridinyl)methyl]pyrazolo[5,4-c]pyridine-4-carboxamide;methyl 3-[[6-[[[1-(4-fluorophenyl)pyrazolo[5,4-c]pyridine-4-carbonyl]amino]methyl]-2-pyridinyl]sulfonyl]propanoate?

The InChIKey is MUFVGCRTEXIEPD-UHFFFAOYSA-N. The full InChI is InChI=1S/C24H22ClN5O4S.C23H21ClN6O4S.C23H22ClN5O3S.C23H20FN5O5S.C21H17ClN4O3S/c25-17-3-5-18(6-4-17)30-23-14-26-12-22(21(23)13-28-30)24(32)27-11-16-1-7-20(8-2-16)35(33,34)29-10-9-19(31)15-29;24-17-2-4-18(5-3-17)30-21-15-25-13-20(19(21)14-28-30)23(31)27-12-16-1-6-22(26-11-16)35(32,33)29-7-9-34-10-8-29;1-3-4-20(15-5-10-22(26-11-15)33(2,31)32)28-23(30)19-12-25-14-21-18(19)13-27-29(21)17-8-6-16(24)7-9-17;1-34-22(30)9-10-35(32,33)21-4-2-3-16(28-21)11-26-23(31)19-12-25-14-20-18(19)13-27-29(20)17-7-5-15(24)6-8-17;1-30(28,29)17-4-2-3-14(9-17)10-24-21(27)19-11-23-13-20-18(19)12-25-26(20)16-7-5-15(22)6-8-16/h1-8,12-14,19,31H,9-11,15H2,(H,27,32);1-6,11,13-15H,7-10,12H2,(H,27,31);5-14,20H,3-4H2,1-2H3,(H,28,30);2-8,12-14H,9-11H2,1H3,(H,26,31);2-9,11-13H,10H2,1H3,(H,24,27).

What are the key properties of 1-(4-chlorophenyl)-N-[[4-(3-hydroxypyrrolidin-1-yl)sulfonylphenyl]methyl]pyrazolo[5,4-c]pyridine-4-carboxamide;1-(4-chlorophenyl)-N-[(3-methylsulfonylphenyl)methyl]pyrazolo[5,4-c]pyridine-4-carboxamide;1-(4-chlorophenyl)-N-[1-(6-methylsulfonyl-3-pyridinyl)butyl]pyrazolo[5,4-c]pyridine-4-carboxamide;1-(4-chlorophenyl)-N-[(6-morpholin-4-ylsulfonyl-3-pyridinyl)methyl]pyrazolo[5,4-c]pyridine-4-carboxamide;methyl 3-[[6-[[[1-(4-fluorophenyl)pyrazolo[5,4-c]pyridine-4-carbonyl]amino]methyl]-2-pyridinyl]sulfonyl]propanoate?

1-(4-chlorophenyl)-N-[[4-(3-hydroxypyrrolidin-1-yl)sulfonylphenyl]methyl]pyrazolo[5,4-c]pyridine-4-carboxamide;1-(4-chlorophenyl)-N-[(3-methylsulfonylphenyl)methyl]pyrazolo[5,4-c]pyridine-4-carboxamide;1-(4-chlorophenyl)-N-[1-(6-methylsulfonyl-3-pyridinyl)butyl]pyrazolo[5,4-c]pyridine-4-carboxamide;1-(4-chlorophenyl)-N-[(6-morpholin-4-ylsulfonyl-3-pyridinyl)methyl]pyrazolo[5,4-c]pyridine-4-carboxamide;methyl 3-[[6-[[[1-(4-fluorophenyl)pyrazolo[5,4-c]pyridine-4-carbonyl]amino]methyl]-2-pyridinyl]sulfonyl]propanoate has a molecular weight of 2447.37 g/mol, XLogP of 14.95, 32 rotatable bonds, 6 hydrogen bond donors, and 37 hydrogen bond acceptors.

Where does this data come from?

All data for 1-(4-chlorophenyl)-N-[[4-(3-hydroxypyrrolidin-1-yl)sulfonylphenyl]methyl]pyrazolo[5,4-c]pyridine-4-carboxamide;1-(4-chlorophenyl)-N-[(3-methylsulfonylphenyl)methyl]pyrazolo[5,4-c]pyridine-4-carboxamide;1-(4-chlorophenyl)-N-[1-(6-methylsulfonyl-3-pyridinyl)butyl]pyrazolo[5,4-c]pyridine-4-carboxamide;1-(4-chlorophenyl)-N-[(6-morpholin-4-ylsulfonyl-3-pyridinyl)methyl]pyrazolo[5,4-c]pyridine-4-carboxamide;methyl 3-[[6-[[[1-(4-fluorophenyl)pyrazolo[5,4-c]pyridine-4-carbonyl]amino]methyl]-2-pyridinyl]sulfonyl]propanoate is sourced from PubChem (CID 159673020), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).