N-[(1R)-1-[4-bromo-1-(4-methylphenyl)sulfonylpyrrol-2-yl]propyl]-1-(4-fluorophenyl)pyrazolo[5,4-c]pyridine-4-carboxamide;N-[(1S)-1-[4-bromo-1-(4-methylphenyl)sulfonylpyrrol-2-yl]propyl]-1-(4-fluorophenyl)pyrazolo[5,4-c]pyridine-4-carboxamide;N-[(1S)-1-(4-bromo-1,3-thiazol-2-yl)ethyl]-1-(4-fluorophenyl)pyrazolo[5,4-c]pyridine-4-carboxamide;N-[(1S)-1-(4-bromo-1,3-thiazol-2-yl)propyl]-1-(4-fluorophenyl)pyrazolo[5,4-c]pyridine-4-carboxamide;1-(4-fluorophenyl)-N-[(1R)-1-[1-(4-methylphenyl)sulfonyl-4-methylsulfonylpyrrol-2-yl]propyl]pyrazolo[5,4-c]pyridine-4-carboxamide

C119H100Br4F5N25O13S6 — CID 159054819

About N-[(1R)-1-[4-bromo-1-(4-methylphenyl)sulfonylpyrrol-2-yl]propyl]-1-(4-fluorophenyl)pyrazolo[5,4-c]pyridine-4-carboxamide;N-[(1S)-1-[4-bromo-1-(4-methylphenyl)sulfonylpyrrol-2-yl]propyl]-1-(4-fluorophenyl)pyrazolo[5,4-c]pyridine-4-carboxamide;N-[(1S)-1-(4-bromo-1,3-thiazol-2-yl)ethyl]-1-(4-fluorophenyl)pyrazolo[5,4-c]pyridine-4-carboxamide;N-[(1S)-1-(4-bromo-1,3-thiazol-2-yl)propyl]-1-(4-fluorophenyl)pyrazolo[5,4-c]pyridine-4-carboxamide;1-(4-fluorophenyl)-N-[(1R)-1-[1-(4-methylphenyl)sulfonyl-4-methylsulfonylpyrrol-2-yl]propyl]pyrazolo[5,4-c]pyridine-4-carboxamide

N-[(1R)-1-[4-bromo-1-(4-methylphenyl)sulfonylpyrrol-2-yl]propyl]-1-(4-fluorophenyl)pyrazolo[5,4-c]pyridine-4-carboxamide;N-[(1S)-1-[4-bromo-1-(4-methylphenyl)sulfonylpyrrol-2-yl]propyl]-1-(4-fluorophenyl)pyrazolo[5,4-c]pyridine-4-carboxamide;N-[(1S)-1-(4-bromo-1,3-thiazol-2-yl)ethyl]-1-(4-fluorophenyl)pyrazolo[5,4-c]pyridine-4-carboxamide;N-[(1S)-1-(4-bromo-1,3-thiazol-2-yl)propyl]-1-(4-fluorophenyl)pyrazolo[5,4-c]pyridine-4-carboxamide;1-(4-fluorophenyl)-N-[(1R)-1-[1-(4-methylphenyl)sulfonyl-4-methylsulfonylpyrrol-2-yl]propyl]pyrazolo[5,4-c]pyridine-4-carboxamide (PubChem CID 159054819) has the molecular formula C119H100Br4F5N25O13S6 and a molecular weight of 2695.28 g/mol. Its IUPAC name is N-[(1R)-1-[4-bromo-1-(4-methylphenyl)sulfonylpyrrol-2-yl]propyl]-1-(4-fluorophenyl)pyrazolo[5,4-c]pyridine-4-carboxamide;N-[(1S)-1-[4-bromo-1-(4-methylphenyl)sulfonylpyrrol-2-yl]propyl]-1-(4-fluorophenyl)pyrazolo[5,4-c]pyridine-4-carboxamide;N-[(1S)-1-(4-bromo-1,3-thiazol-2-yl)ethyl]-1-(4-fluorophenyl)pyrazolo[5,4-c]pyridine-4-carboxamide;N-[(1S)-1-(4-bromo-1,3-thiazol-2-yl)propyl]-1-(4-fluorophenyl)pyrazolo[5,4-c]pyridine-4-carboxamide;1-(4-fluorophenyl)-N-[(1R)-1-[1-(4-methylphenyl)sulfonyl-4-methylsulfonylpyrrol-2-yl]propyl]pyrazolo[5,4-c]pyridine-4-carboxamide.

Molecular Properties

• Compound Name: N-[(1R)-1-[4-bromo-1-(4-methylphenyl)sulfonylpyrrol-2-yl]propyl]-1-(4-fluorophenyl)pyrazolo[5,4-c]pyridine-4-carboxamide;N-[(1S)-1-[4-bromo-1-(4-methylphenyl)sulfonylpyrrol-2-yl]propyl]-1-(4-fluorophenyl)pyrazolo[5,4-c]pyridine-4-carboxamide;N-[(1S)-1-(4-bromo-1,3-thiazol-2-yl)ethyl]-1-(4-fluorophenyl)pyrazolo[5,4-c]pyridine-4-carboxamide;N-[(1S)-1-(4-bromo-1,3-thiazol-2-yl)propyl]-1-(4-fluorophenyl)pyrazolo[5,4-c]pyridine-4-carboxamide;1-(4-fluorophenyl)-N-[(1R)-1-[1-(4-methylphenyl)sulfonyl-4-methylsulfonylpyrrol-2-yl]propyl]pyrazolo[5,4-c]pyridine-4-carboxamide
• PubChem CID: 159054819
• Molecular Formula: C119H100Br4F5N25O13S6
• Molecular Weight: 2695.28 g/mol
• Exact Mass: 2689.29
• IUPAC Name: N-[(1R)-1-[4-bromo-1-(4-methylphenyl)sulfonylpyrrol-2-yl]propyl]-1-(4-fluorophenyl)pyrazolo[5,4-c]pyridine-4-carboxamide;N-[(1S)-1-[4-bromo-1-(4-methylphenyl)sulfonylpyrrol-2-yl]propyl]-1-(4-fluorophenyl)pyrazolo[5,4-c]pyridine-4-carboxamide;N-[(1S)-1-(4-bromo-1,3-thiazol-2-yl)ethyl]-1-(4-fluorophenyl)pyrazolo[5,4-c]pyridine-4-carboxamide;N-[(1S)-1-(4-bromo-1,3-thiazol-2-yl)propyl]-1-(4-fluorophenyl)pyrazolo[5,4-c]pyridine-4-carboxamide;1-(4-fluorophenyl)-N-[(1R)-1-[1-(4-methylphenyl)sulfonyl-4-methylsulfonylpyrrol-2-yl]propyl]pyrazolo[5,4-c]pyridine-4-carboxamide
• SMILES: CC[C@@H](NC(=O)c1cncc2c1cnn2-c1ccc(F)cc1)c1cc(Br)cn1S(=O)(=O)c1ccc(C)cc1.CC[C@@H](NC(=O)c1cncc2c1cnn2-c1ccc(F)cc1)c1cc(S(C)(=O)=O)cn1S(=O)(=O)c1ccc(C)cc1.CC[C@H](NC(=O)c1cncc2c1cnn2-c1ccc(F)cc1)c1cc(Br)cn1S(=O)(=O)c1ccc(C)cc1.CC[C@H](NC(=O)c1cncc2c1cnn2-c1ccc(F)cc1)c1nc(Br)cs1.C[C@H](NC(=O)c1cncc2c1cnn2-c1ccc(F)cc1)c1nc(Br)cs1
• InChI: InChI=1S/C28H26FN5O5S2.2C27H23BrFN5O3S.C19H15BrFN5OS.C18H13BrFN5OS/c1-4-25(26-13-22(40(3,36)37)17-33(26)41(38,39)21-11-5-18(2)6-12-21)32-28(35)24-14-30-16-27-23(24)15-31-34(27)20-9-7-19(29)8-10-20;2*1-3-24(25-12-18(28)16-33(25)38(36,37)21-10-4-17(2)5-11-21)32-27(35)23-13-30-15-26-22(23)14-31-34(26)20-8-6-19(29)7-9-20;1-2-15(19-25-17(20)10-28-19)24-18(27)14-7-22-9-16-13(14)8-23-26(16)12-5-3-11(21)4-6-12;1-10(18-24-16(19)9-27-18)23-17(26)14-6-21-8-15-13(14)7-22-25(15)12-4-2-11(20)3-5-12/h5-17,25H,4H2,1-3H3,(H,32,35);2*4-16,24H,3H2,1-2H3,(H,32,35);3-10,15H,2H2,1H3,(H,24,27);2-10H,1H3,(H,23,26)/t25-;2*24-;15-;10-/m11000/s1
• InChIKey: JXSMKUNYHRSRKF-VHPVUGKHSA-N
• XLogP: 24.22
• TPSA: 476.18 Ų
• H-Bond Donors: 5
• H-Bond Acceptors: 35
• Rotatable Bonds: 31
• Heavy Atoms: 172
• Complexity: —

Lipinski Rule of Five

3 violations

Rule	Value
MW ≤ 500	2695.28
LogP ≤ 5	24.22
H-Bond Donors ≤ 5	5
H-Bond Acceptors ≤ 10	35

Frequently Asked Questions

What is the IUPAC name of N-[(1R)-1-[4-bromo-1-(4-methylphenyl)sulfonylpyrrol-2-yl]propyl]-1-(4-fluorophenyl)pyrazolo[5,4-c]pyridine-4-carboxamide;N-[(1S)-1-[4-bromo-1-(4-methylphenyl)sulfonylpyrrol-2-yl]propyl]-1-(4-fluorophenyl)pyrazolo[5,4-c]pyridine-4-carboxamide;N-[(1S)-1-(4-bromo-1,3-thiazol-2-yl)ethyl]-1-(4-fluorophenyl)pyrazolo[5,4-c]pyridine-4-carboxamide;N-[(1S)-1-(4-bromo-1,3-thiazol-2-yl)propyl]-1-(4-fluorophenyl)pyrazolo[5,4-c]pyridine-4-carboxamide;1-(4-fluorophenyl)-N-[(1R)-1-[1-(4-methylphenyl)sulfonyl-4-methylsulfonylpyrrol-2-yl]propyl]pyrazolo[5,4-c]pyridine-4-carboxamide?

The IUPAC name of N-[(1R)-1-[4-bromo-1-(4-methylphenyl)sulfonylpyrrol-2-yl]propyl]-1-(4-fluorophenyl)pyrazolo[5,4-c]pyridine-4-carboxamide;N-[(1S)-1-[4-bromo-1-(4-methylphenyl)sulfonylpyrrol-2-yl]propyl]-1-(4-fluorophenyl)pyrazolo[5,4-c]pyridine-4-carboxamide;N-[(1S)-1-(4-bromo-1,3-thiazol-2-yl)ethyl]-1-(4-fluorophenyl)pyrazolo[5,4-c]pyridine-4-carboxamide;N-[(1S)-1-(4-bromo-1,3-thiazol-2-yl)propyl]-1-(4-fluorophenyl)pyrazolo[5,4-c]pyridine-4-carboxamide;1-(4-fluorophenyl)-N-[(1R)-1-[1-(4-methylphenyl)sulfonyl-4-methylsulfonylpyrrol-2-yl]propyl]pyrazolo[5,4-c]pyridine-4-carboxamide (CID 159054819) is N-[(1R)-1-[4-bromo-1-(4-methylphenyl)sulfonylpyrrol-2-yl]propyl]-1-(4-fluorophenyl)pyrazolo[5,4-c]pyridine-4-carboxamide;N-[(1S)-1-[4-bromo-1-(4-methylphenyl)sulfonylpyrrol-2-yl]propyl]-1-(4-fluorophenyl)pyrazolo[5,4-c]pyridine-4-carboxamide;N-[(1S)-1-(4-bromo-1,3-thiazol-2-yl)ethyl]-1-(4-fluorophenyl)pyrazolo[5,4-c]pyridine-4-carboxamide;N-[(1S)-1-(4-bromo-1,3-thiazol-2-yl)propyl]-1-(4-fluorophenyl)pyrazolo[5,4-c]pyridine-4-carboxamide;1-(4-fluorophenyl)-N-[(1R)-1-[1-(4-methylphenyl)sulfonyl-4-methylsulfonylpyrrol-2-yl]propyl]pyrazolo[5,4-c]pyridine-4-carboxamide.

What is the SMILES notation for N-[(1R)-1-[4-bromo-1-(4-methylphenyl)sulfonylpyrrol-2-yl]propyl]-1-(4-fluorophenyl)pyrazolo[5,4-c]pyridine-4-carboxamide;N-[(1S)-1-[4-bromo-1-(4-methylphenyl)sulfonylpyrrol-2-yl]propyl]-1-(4-fluorophenyl)pyrazolo[5,4-c]pyridine-4-carboxamide;N-[(1S)-1-(4-bromo-1,3-thiazol-2-yl)ethyl]-1-(4-fluorophenyl)pyrazolo[5,4-c]pyridine-4-carboxamide;N-[(1S)-1-(4-bromo-1,3-thiazol-2-yl)propyl]-1-(4-fluorophenyl)pyrazolo[5,4-c]pyridine-4-carboxamide;1-(4-fluorophenyl)-N-[(1R)-1-[1-(4-methylphenyl)sulfonyl-4-methylsulfonylpyrrol-2-yl]propyl]pyrazolo[5,4-c]pyridine-4-carboxamide?

The canonical SMILES for N-[(1R)-1-[4-bromo-1-(4-methylphenyl)sulfonylpyrrol-2-yl]propyl]-1-(4-fluorophenyl)pyrazolo[5,4-c]pyridine-4-carboxamide;N-[(1S)-1-[4-bromo-1-(4-methylphenyl)sulfonylpyrrol-2-yl]propyl]-1-(4-fluorophenyl)pyrazolo[5,4-c]pyridine-4-carboxamide;N-[(1S)-1-(4-bromo-1,3-thiazol-2-yl)ethyl]-1-(4-fluorophenyl)pyrazolo[5,4-c]pyridine-4-carboxamide;N-[(1S)-1-(4-bromo-1,3-thiazol-2-yl)propyl]-1-(4-fluorophenyl)pyrazolo[5,4-c]pyridine-4-carboxamide;1-(4-fluorophenyl)-N-[(1R)-1-[1-(4-methylphenyl)sulfonyl-4-methylsulfonylpyrrol-2-yl]propyl]pyrazolo[5,4-c]pyridine-4-carboxamide is CC[C@@H](NC(=O)c1cncc2c1cnn2-c1ccc(F)cc1)c1cc(Br)cn1S(=O)(=O)c1ccc(C)cc1.CC[C@@H](NC(=O)c1cncc2c1cnn2-c1ccc(F)cc1)c1cc(S(C)(=O)=O)cn1S(=O)(=O)c1ccc(C)cc1.CC[C@H](NC(=O)c1cncc2c1cnn2-c1ccc(F)cc1)c1cc(Br)cn1S(=O)(=O)c1ccc(C)cc1.CC[C@H](NC(=O)c1cncc2c1cnn2-c1ccc(F)cc1)c1nc(Br)cs1.C[C@H](NC(=O)c1cncc2c1cnn2-c1ccc(F)cc1)c1nc(Br)cs1.

What is the InChIKey of N-[(1R)-1-[4-bromo-1-(4-methylphenyl)sulfonylpyrrol-2-yl]propyl]-1-(4-fluorophenyl)pyrazolo[5,4-c]pyridine-4-carboxamide;N-[(1S)-1-[4-bromo-1-(4-methylphenyl)sulfonylpyrrol-2-yl]propyl]-1-(4-fluorophenyl)pyrazolo[5,4-c]pyridine-4-carboxamide;N-[(1S)-1-(4-bromo-1,3-thiazol-2-yl)ethyl]-1-(4-fluorophenyl)pyrazolo[5,4-c]pyridine-4-carboxamide;N-[(1S)-1-(4-bromo-1,3-thiazol-2-yl)propyl]-1-(4-fluorophenyl)pyrazolo[5,4-c]pyridine-4-carboxamide;1-(4-fluorophenyl)-N-[(1R)-1-[1-(4-methylphenyl)sulfonyl-4-methylsulfonylpyrrol-2-yl]propyl]pyrazolo[5,4-c]pyridine-4-carboxamide?

The InChIKey is JXSMKUNYHRSRKF-VHPVUGKHSA-N. The full InChI is InChI=1S/C28H26FN5O5S2.2C27H23BrFN5O3S.C19H15BrFN5OS.C18H13BrFN5OS/c1-4-25(26-13-22(40(3,36)37)17-33(26)41(38,39)21-11-5-18(2)6-12-21)32-28(35)24-14-30-16-27-23(24)15-31-34(27)20-9-7-19(29)8-10-20;2*1-3-24(25-12-18(28)16-33(25)38(36,37)21-10-4-17(2)5-11-21)32-27(35)23-13-30-15-26-22(23)14-31-34(26)20-8-6-19(29)7-9-20;1-2-15(19-25-17(20)10-28-19)24-18(27)14-7-22-9-16-13(14)8-23-26(16)12-5-3-11(21)4-6-12;1-10(18-24-16(19)9-27-18)23-17(26)14-6-21-8-15-13(14)7-22-25(15)12-4-2-11(20)3-5-12/h5-17,25H,4H2,1-3H3,(H,32,35);2*4-16,24H,3H2,1-2H3,(H,32,35);3-10,15H,2H2,1H3,(H,24,27);2-10H,1H3,(H,23,26)/t25-;2*24-;15-;10-/m11000/s1.

What are the key properties of N-[(1R)-1-[4-bromo-1-(4-methylphenyl)sulfonylpyrrol-2-yl]propyl]-1-(4-fluorophenyl)pyrazolo[5,4-c]pyridine-4-carboxamide;N-[(1S)-1-[4-bromo-1-(4-methylphenyl)sulfonylpyrrol-2-yl]propyl]-1-(4-fluorophenyl)pyrazolo[5,4-c]pyridine-4-carboxamide;N-[(1S)-1-(4-bromo-1,3-thiazol-2-yl)ethyl]-1-(4-fluorophenyl)pyrazolo[5,4-c]pyridine-4-carboxamide;N-[(1S)-1-(4-bromo-1,3-thiazol-2-yl)propyl]-1-(4-fluorophenyl)pyrazolo[5,4-c]pyridine-4-carboxamide;1-(4-fluorophenyl)-N-[(1R)-1-[1-(4-methylphenyl)sulfonyl-4-methylsulfonylpyrrol-2-yl]propyl]pyrazolo[5,4-c]pyridine-4-carboxamide?

N-[(1R)-1-[4-bromo-1-(4-methylphenyl)sulfonylpyrrol-2-yl]propyl]-1-(4-fluorophenyl)pyrazolo[5,4-c]pyridine-4-carboxamide;N-[(1S)-1-[4-bromo-1-(4-methylphenyl)sulfonylpyrrol-2-yl]propyl]-1-(4-fluorophenyl)pyrazolo[5,4-c]pyridine-4-carboxamide;N-[(1S)-1-(4-bromo-1,3-thiazol-2-yl)ethyl]-1-(4-fluorophenyl)pyrazolo[5,4-c]pyridine-4-carboxamide;N-[(1S)-1-(4-bromo-1,3-thiazol-2-yl)propyl]-1-(4-fluorophenyl)pyrazolo[5,4-c]pyridine-4-carboxamide;1-(4-fluorophenyl)-N-[(1R)-1-[1-(4-methylphenyl)sulfonyl-4-methylsulfonylpyrrol-2-yl]propyl]pyrazolo[5,4-c]pyridine-4-carboxamide has a molecular weight of 2695.28 g/mol, XLogP of 24.22, 31 rotatable bonds, 5 hydrogen bond donors, and 35 hydrogen bond acceptors.

Where does this data come from?

All data for N-[(1R)-1-[4-bromo-1-(4-methylphenyl)sulfonylpyrrol-2-yl]propyl]-1-(4-fluorophenyl)pyrazolo[5,4-c]pyridine-4-carboxamide;N-[(1S)-1-[4-bromo-1-(4-methylphenyl)sulfonylpyrrol-2-yl]propyl]-1-(4-fluorophenyl)pyrazolo[5,4-c]pyridine-4-carboxamide;N-[(1S)-1-(4-bromo-1,3-thiazol-2-yl)ethyl]-1-(4-fluorophenyl)pyrazolo[5,4-c]pyridine-4-carboxamide;N-[(1S)-1-(4-bromo-1,3-thiazol-2-yl)propyl]-1-(4-fluorophenyl)pyrazolo[5,4-c]pyridine-4-carboxamide;1-(4-fluorophenyl)-N-[(1R)-1-[1-(4-methylphenyl)sulfonyl-4-methylsulfonylpyrrol-2-yl]propyl]pyrazolo[5,4-c]pyridine-4-carboxamide is sourced from PubChem (CID 159054819), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).