About N-[3-[5-(2-cyclopropyl-4-methylpyrimidin-5-yl)-2H-pyrazolo[3,4-b]pyridine-3-carbonyl]-2,6-difluorophenyl]propane-1-sulfonamide;N-[3-[5-(2-cyclopropyl-4-methylsulfanylpyrimidin-5-yl)-2H-pyrazolo[3,4-b]pyridine-3-carbonyl]-2,6-difluorophenyl]propane-1-sulfonamide;N-[2,6-difluoro-3-[5-(2-methyl-6-oxo-1H-pyrimidin-5-yl)-2H-pyrazolo[3,4-b]pyridine-3-carbonyl]phenyl]propane-1-sulfonamide;N-[2,6-difluoro-3-[5-(4-methylpyrimidin-5-yl)-2H-pyrazolo[3,4-b]pyridine-3-carbonyl]phenyl]propane-1-sulfonamide;N-[3-[5-(2,4-dimethoxypyrimidin-5-yl)-2H-pyrazolo[3,4-b]pyridine-3-carbonyl]-2,6-difluorophenyl]propane-1-sulfonamide;N-[3-[5-(2,4-dimethylpyrimidin-5-yl)-2H-pyrazolo[3,4-b]pyridine-3-carbonyl]-2,6-difluorophenyl]propane-1-sulfonamide
N-[3-[5-(2-cyclopropyl-4-methylpyrimidin-5-yl)-2H-pyrazolo[3,4-b]pyridine-3-carbonyl]-2,6-difluorophenyl]propane-1-sulfonamide;N-[3-[5-(2-cyclopropyl-4-methylsulfanylpyrimidin-5-yl)-2H-pyrazolo[3,4-b]pyridine-3-carbonyl]-2,6-difluorophenyl]propane-1-sulfonamide;N-[2,6-difluoro-3-[5-(2-methyl-6-oxo-1H-pyrimidin-5-yl)-2H-pyrazolo[3,4-b]pyridine-3-carbonyl]phenyl]propane-1-sulfonamide;N-[2,6-difluoro-3-[5-(4-methylpyrimidin-5-yl)-2H-pyrazolo[3,4-b]pyridine-3-carbonyl]phenyl]propane-1-sulfonamide;N-[3-[5-(2,4-dimethoxypyrimidin-5-yl)-2H-pyrazolo[3,4-b]pyridine-3-carbonyl]-2,6-difluorophenyl]propane-1-sulfonamide;N-[3-[5-(2,4-dimethylpyrimidin-5-yl)-2H-pyrazolo[3,4-b]pyridine-3-carbonyl]-2,6-difluorophenyl]propane-1-sulfonamide (PubChem CID 167692901) has the molecular formula C134H120F12N36O21S7
and a molecular weight of 3023.11 g/mol. Its IUPAC name is N-[3-[5-(2-cyclopropyl-4-methylpyrimidin-5-yl)-2H-pyrazolo[3,4-b]pyridine-3-carbonyl]-2,6-difluorophenyl]propane-1-sulfonamide;N-[3-[5-(2-cyclopropyl-4-methylsulfanylpyrimidin-5-yl)-2H-pyrazolo[3,4-b]pyridine-3-carbonyl]-2,6-difluorophenyl]propane-1-sulfonamide;N-[2,6-difluoro-3-[5-(2-methyl-6-oxo-1H-pyrimidin-5-yl)-2H-pyrazolo[3,4-b]pyridine-3-carbonyl]phenyl]propane-1-sulfonamide;N-[2,6-difluoro-3-[5-(4-methylpyrimidin-5-yl)-2H-pyrazolo[3,4-b]pyridine-3-carbonyl]phenyl]propane-1-sulfonamide;N-[3-[5-(2,4-dimethoxypyrimidin-5-yl)-2H-pyrazolo[3,4-b]pyridine-3-carbonyl]-2,6-difluorophenyl]propane-1-sulfonamide;N-[3-[5-(2,4-dimethylpyrimidin-5-yl)-2H-pyrazolo[3,4-b]pyridine-3-carbonyl]-2,6-difluorophenyl]propane-1-sulfonamide.
Frequently Asked Questions
What is the IUPAC name of N-[3-[5-(2-cyclopropyl-4-methylpyrimidin-5-yl)-2H-pyrazolo[3,4-b]pyridine-3-carbonyl]-2,6-difluorophenyl]propane-1-sulfonamide;N-[3-[5-(2-cyclopropyl-4-methylsulfanylpyrimidin-5-yl)-2H-pyrazolo[3,4-b]pyridine-3-carbonyl]-2,6-difluorophenyl]propane-1-sulfonamide;N-[2,6-difluoro-3-[5-(2-methyl-6-oxo-1H-pyrimidin-5-yl)-2H-pyrazolo[3,4-b]pyridine-3-carbonyl]phenyl]propane-1-sulfonamide;N-[2,6-difluoro-3-[5-(4-methylpyrimidin-5-yl)-2H-pyrazolo[3,4-b]pyridine-3-carbonyl]phenyl]propane-1-sulfonamide;N-[3-[5-(2,4-dimethoxypyrimidin-5-yl)-2H-pyrazolo[3,4-b]pyridine-3-carbonyl]-2,6-difluorophenyl]propane-1-sulfonamide;N-[3-[5-(2,4-dimethylpyrimidin-5-yl)-2H-pyrazolo[3,4-b]pyridine-3-carbonyl]-2,6-difluorophenyl]propane-1-sulfonamide?
The IUPAC name of N-[3-[5-(2-cyclopropyl-4-methylpyrimidin-5-yl)-2H-pyrazolo[3,4-b]pyridine-3-carbonyl]-2,6-difluorophenyl]propane-1-sulfonamide;N-[3-[5-(2-cyclopropyl-4-methylsulfanylpyrimidin-5-yl)-2H-pyrazolo[3,4-b]pyridine-3-carbonyl]-2,6-difluorophenyl]propane-1-sulfonamide;N-[2,6-difluoro-3-[5-(2-methyl-6-oxo-1H-pyrimidin-5-yl)-2H-pyrazolo[3,4-b]pyridine-3-carbonyl]phenyl]propane-1-sulfonamide;N-[2,6-difluoro-3-[5-(4-methylpyrimidin-5-yl)-2H-pyrazolo[3,4-b]pyridine-3-carbonyl]phenyl]propane-1-sulfonamide;N-[3-[5-(2,4-dimethoxypyrimidin-5-yl)-2H-pyrazolo[3,4-b]pyridine-3-carbonyl]-2,6-difluorophenyl]propane-1-sulfonamide;N-[3-[5-(2,4-dimethylpyrimidin-5-yl)-2H-pyrazolo[3,4-b]pyridine-3-carbonyl]-2,6-difluorophenyl]propane-1-sulfonamide (CID 167692901) is N-[3-[5-(2-cyclopropyl-4-methylpyrimidin-5-yl)-2H-pyrazolo[3,4-b]pyridine-3-carbonyl]-2,6-difluorophenyl]propane-1-sulfonamide;N-[3-[5-(2-cyclopropyl-4-methylsulfanylpyrimidin-5-yl)-2H-pyrazolo[3,4-b]pyridine-3-carbonyl]-2,6-difluorophenyl]propane-1-sulfonamide;N-[2,6-difluoro-3-[5-(2-methyl-6-oxo-1H-pyrimidin-5-yl)-2H-pyrazolo[3,4-b]pyridine-3-carbonyl]phenyl]propane-1-sulfonamide;N-[2,6-difluoro-3-[5-(4-methylpyrimidin-5-yl)-2H-pyrazolo[3,4-b]pyridine-3-carbonyl]phenyl]propane-1-sulfonamide;N-[3-[5-(2,4-dimethoxypyrimidin-5-yl)-2H-pyrazolo[3,4-b]pyridine-3-carbonyl]-2,6-difluorophenyl]propane-1-sulfonamide;N-[3-[5-(2,4-dimethylpyrimidin-5-yl)-2H-pyrazolo[3,4-b]pyridine-3-carbonyl]-2,6-difluorophenyl]propane-1-sulfonamide.
What is the SMILES notation for N-[3-[5-(2-cyclopropyl-4-methylpyrimidin-5-yl)-2H-pyrazolo[3,4-b]pyridine-3-carbonyl]-2,6-difluorophenyl]propane-1-sulfonamide;N-[3-[5-(2-cyclopropyl-4-methylsulfanylpyrimidin-5-yl)-2H-pyrazolo[3,4-b]pyridine-3-carbonyl]-2,6-difluorophenyl]propane-1-sulfonamide;N-[2,6-difluoro-3-[5-(2-methyl-6-oxo-1H-pyrimidin-5-yl)-2H-pyrazolo[3,4-b]pyridine-3-carbonyl]phenyl]propane-1-sulfonamide;N-[2,6-difluoro-3-[5-(4-methylpyrimidin-5-yl)-2H-pyrazolo[3,4-b]pyridine-3-carbonyl]phenyl]propane-1-sulfonamide;N-[3-[5-(2,4-dimethoxypyrimidin-5-yl)-2H-pyrazolo[3,4-b]pyridine-3-carbonyl]-2,6-difluorophenyl]propane-1-sulfonamide;N-[3-[5-(2,4-dimethylpyrimidin-5-yl)-2H-pyrazolo[3,4-b]pyridine-3-carbonyl]-2,6-difluorophenyl]propane-1-sulfonamide?
The canonical SMILES for N-[3-[5-(2-cyclopropyl-4-methylpyrimidin-5-yl)-2H-pyrazolo[3,4-b]pyridine-3-carbonyl]-2,6-difluorophenyl]propane-1-sulfonamide;N-[3-[5-(2-cyclopropyl-4-methylsulfanylpyrimidin-5-yl)-2H-pyrazolo[3,4-b]pyridine-3-carbonyl]-2,6-difluorophenyl]propane-1-sulfonamide;N-[2,6-difluoro-3-[5-(2-methyl-6-oxo-1H-pyrimidin-5-yl)-2H-pyrazolo[3,4-b]pyridine-3-carbonyl]phenyl]propane-1-sulfonamide;N-[2,6-difluoro-3-[5-(4-methylpyrimidin-5-yl)-2H-pyrazolo[3,4-b]pyridine-3-carbonyl]phenyl]propane-1-sulfonamide;N-[3-[5-(2,4-dimethoxypyrimidin-5-yl)-2H-pyrazolo[3,4-b]pyridine-3-carbonyl]-2,6-difluorophenyl]propane-1-sulfonamide;N-[3-[5-(2,4-dimethylpyrimidin-5-yl)-2H-pyrazolo[3,4-b]pyridine-3-carbonyl]-2,6-difluorophenyl]propane-1-sulfonamide is CCCS(=O)(=O)Nc1c(F)ccc(C(=O)c2[nH]nc3ncc(-c4cnc(C)[nH]c4=O)cc23)c1F.CCCS(=O)(=O)Nc1c(F)ccc(C(=O)c2[nH]nc3ncc(-c4cnc(C)nc4C)cc23)c1F.CCCS(=O)(=O)Nc1c(F)ccc(C(=O)c2[nH]nc3ncc(-c4cnc(C5CC5)nc4C)cc23)c1F.CCCS(=O)(=O)Nc1c(F)ccc(C(=O)c2[nH]nc3ncc(-c4cnc(C5CC5)nc4SC)cc23)c1F.CCCS(=O)(=O)Nc1c(F)ccc(C(=O)c2[nH]nc3ncc(-c4cnc(OC)nc4OC)cc23)c1F.CCCS(=O)(=O)Nc1c(F)ccc(C(=O)c2[nH]nc3ncc(-c4cncnc4C)cc23)c1F.
What is the InChIKey of N-[3-[5-(2-cyclopropyl-4-methylpyrimidin-5-yl)-2H-pyrazolo[3,4-b]pyridine-3-carbonyl]-2,6-difluorophenyl]propane-1-sulfonamide;N-[3-[5-(2-cyclopropyl-4-methylsulfanylpyrimidin-5-yl)-2H-pyrazolo[3,4-b]pyridine-3-carbonyl]-2,6-difluorophenyl]propane-1-sulfonamide;N-[2,6-difluoro-3-[5-(2-methyl-6-oxo-1H-pyrimidin-5-yl)-2H-pyrazolo[3,4-b]pyridine-3-carbonyl]phenyl]propane-1-sulfonamide;N-[2,6-difluoro-3-[5-(4-methylpyrimidin-5-yl)-2H-pyrazolo[3,4-b]pyridine-3-carbonyl]phenyl]propane-1-sulfonamide;N-[3-[5-(2,4-dimethoxypyrimidin-5-yl)-2H-pyrazolo[3,4-b]pyridine-3-carbonyl]-2,6-difluorophenyl]propane-1-sulfonamide;N-[3-[5-(2,4-dimethylpyrimidin-5-yl)-2H-pyrazolo[3,4-b]pyridine-3-carbonyl]-2,6-difluorophenyl]propane-1-sulfonamide?
The InChIKey is XFHCFOVTFNWTFP-UHFFFAOYSA-N. The full InChI is InChI=1S/C24H22F2N6O3S2.C24H22F2N6O3S.C22H20F2N6O5S.C22H20F2N6O3S.C21H18F2N6O4S.C21H18F2N6O3S/c1-3-8-37(34,35)32-20-17(25)7-6-14(18(20)26)21(33)19-15-9-13(10-27-23(15)31-30-19)16-11-28-22(12-4-5-12)29-24(16)36-2;1-3-8-36(34,35)32-21-18(25)7-6-15(19(21)26)22(33)20-16-9-14(10-27-24(16)31-30-20)17-11-28-23(13-4-5-13)29-12(17)2;1-4-7-36(32,33)30-18-15(23)6-5-12(16(18)24)19(31)17-13-8-11(9-25-20(13)29-28-17)14-10-26-22(35-3)27-21(14)34-2;1-4-7-34(32,33)30-20-17(23)6-5-14(18(20)24)21(31)19-15-8-13(9-26-22(15)29-28-19)16-10-25-12(3)27-11(16)2;1-3-6-34(32,33)29-18-15(22)5-4-12(16(18)23)19(30)17-13-7-11(8-25-20(13)28-27-17)14-9-24-10(2)26-21(14)31;1-3-6-33(31,32)29-19-16(22)5-4-13(17(19)23)20(30)18-14-7-12(8-25-21(14)28-27-18)15-9-24-10-26-11(15)2/h6-7,9-12,32H,3-5,8H2,1-2H3,(H,27,30,31);6-7,9-11,13,32H,3-5,8H2,1-2H3,(H,27,30,31);5-6,8-10,30H,4,7H2,1-3H3,(H,25,28,29);5-6,8-10,30H,4,7H2,1-3H3,(H,26,28,29);4-5,7-9,29H,3,6H2,1-2H3,(H,24,26,31)(H,25,27,28);4-5,7-10,29H,3,6H2,1-2H3,(H,25,27,28).
What are the key properties of N-[3-[5-(2-cyclopropyl-4-methylpyrimidin-5-yl)-2H-pyrazolo[3,4-b]pyridine-3-carbonyl]-2,6-difluorophenyl]propane-1-sulfonamide;N-[3-[5-(2-cyclopropyl-4-methylsulfanylpyrimidin-5-yl)-2H-pyrazolo[3,4-b]pyridine-3-carbonyl]-2,6-difluorophenyl]propane-1-sulfonamide;N-[2,6-difluoro-3-[5-(2-methyl-6-oxo-1H-pyrimidin-5-yl)-2H-pyrazolo[3,4-b]pyridine-3-carbonyl]phenyl]propane-1-sulfonamide;N-[2,6-difluoro-3-[5-(4-methylpyrimidin-5-yl)-2H-pyrazolo[3,4-b]pyridine-3-carbonyl]phenyl]propane-1-sulfonamide;N-[3-[5-(2,4-dimethoxypyrimidin-5-yl)-2H-pyrazolo[3,4-b]pyridine-3-carbonyl]-2,6-difluorophenyl]propane-1-sulfonamide;N-[3-[5-(2,4-dimethylpyrimidin-5-yl)-2H-pyrazolo[3,4-b]pyridine-3-carbonyl]-2,6-difluorophenyl]propane-1-sulfonamide?
N-[3-[5-(2-cyclopropyl-4-methylpyrimidin-5-yl)-2H-pyrazolo[3,4-b]pyridine-3-carbonyl]-2,6-difluorophenyl]propane-1-sulfonamide;N-[3-[5-(2-cyclopropyl-4-methylsulfanylpyrimidin-5-yl)-2H-pyrazolo[3,4-b]pyridine-3-carbonyl]-2,6-difluorophenyl]propane-1-sulfonamide;N-[2,6-difluoro-3-[5-(2-methyl-6-oxo-1H-pyrimidin-5-yl)-2H-pyrazolo[3,4-b]pyridine-3-carbonyl]phenyl]propane-1-sulfonamide;N-[2,6-difluoro-3-[5-(4-methylpyrimidin-5-yl)-2H-pyrazolo[3,4-b]pyridine-3-carbonyl]phenyl]propane-1-sulfonamide;N-[3-[5-(2,4-dimethoxypyrimidin-5-yl)-2H-pyrazolo[3,4-b]pyridine-3-carbonyl]-2,6-difluorophenyl]propane-1-sulfonamide;N-[3-[5-(2,4-dimethylpyrimidin-5-yl)-2H-pyrazolo[3,4-b]pyridine-3-carbonyl]-2,6-difluorophenyl]propane-1-sulfonamide has a molecular weight of 3023.11 g/mol, XLogP of 21.78, 47 rotatable bonds, 13 hydrogen bond donors, and 45 hydrogen bond acceptors.
Where does this data come from?
All data for N-[3-[5-(2-cyclopropyl-4-methylpyrimidin-5-yl)-2H-pyrazolo[3,4-b]pyridine-3-carbonyl]-2,6-difluorophenyl]propane-1-sulfonamide;N-[3-[5-(2-cyclopropyl-4-methylsulfanylpyrimidin-5-yl)-2H-pyrazolo[3,4-b]pyridine-3-carbonyl]-2,6-difluorophenyl]propane-1-sulfonamide;N-[2,6-difluoro-3-[5-(2-methyl-6-oxo-1H-pyrimidin-5-yl)-2H-pyrazolo[3,4-b]pyridine-3-carbonyl]phenyl]propane-1-sulfonamide;N-[2,6-difluoro-3-[5-(4-methylpyrimidin-5-yl)-2H-pyrazolo[3,4-b]pyridine-3-carbonyl]phenyl]propane-1-sulfonamide;N-[3-[5-(2,4-dimethoxypyrimidin-5-yl)-2H-pyrazolo[3,4-b]pyridine-3-carbonyl]-2,6-difluorophenyl]propane-1-sulfonamide;N-[3-[5-(2,4-dimethylpyrimidin-5-yl)-2H-pyrazolo[3,4-b]pyridine-3-carbonyl]-2,6-difluorophenyl]propane-1-sulfonamide is sourced from PubChem (CID 167692901), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).