About N-[2-chloro-4-fluoro-3-[2-(1H-pyrrolo[2,3-b]pyridin-5-yl)acetyl]phenyl]propane-1-sulfonamide;N-[2,4-dichloro-3-[2-(1H-pyrrolo[2,3-b]pyridin-5-yl)acetyl]phenyl]propane-1-sulfonamide;N-[2,4-difluoro-3-[2-[2-(hydroxymethyl)-1H-pyrrolo[2,3-b]pyridin-5-yl]acetyl]phenyl]propane-1-sulfonamide;1-[2,6-difluoro-3-(propylsulfamoylamino)phenyl]-2-(1H-pyrrolo[2,3-b]pyridin-5-yl)ethanone;2,6-difluoro-N-(1H-pyrrolo[2,3-b]pyridin-5-yl)-3-(2,2,2-trifluoroethylsulfonylamino)benzamide;N-[3-[2-[2-[(dimethylamino)methyl]-1H-pyrrolo[2,3-b]pyridin-5-yl]acetyl]-2,4-difluorophenyl]propane-1-sulfonamide;5-[2-[3-[[ethyl(methyl)sulfamoyl]amino]-2,6-difluorophenyl]-2-oxoethyl]-1H-pyrrolo[2,3-b]pyridine;N-[3-[2-(2-ethynyl-1H-pyrrolo[2,3-b]pyridin-5-yl)acetyl]-2,4-difluorophenyl]propane-1-sulfonamide
N-[2-chloro-4-fluoro-3-[2-(1H-pyrrolo[2,3-b]pyridin-5-yl)acetyl]phenyl]propane-1-sulfonamide;N-[2,4-dichloro-3-[2-(1H-pyrrolo[2,3-b]pyridin-5-yl)acetyl]phenyl]propane-1-sulfonamide;N-[2,4-difluoro-3-[2-[2-(hydroxymethyl)-1H-pyrrolo[2,3-b]pyridin-5-yl]acetyl]phenyl]propane-1-sulfonamide;1-[2,6-difluoro-3-(propylsulfamoylamino)phenyl]-2-(1H-pyrrolo[2,3-b]pyridin-5-yl)ethanone;2,6-difluoro-N-(1H-pyrrolo[2,3-b]pyridin-5-yl)-3-(2,2,2-trifluoroethylsulfonylamino)benzamide;N-[3-[2-[2-[(dimethylamino)methyl]-1H-pyrrolo[2,3-b]pyridin-5-yl]acetyl]-2,4-difluorophenyl]propane-1-sulfonamide;5-[2-[3-[[ethyl(methyl)sulfamoyl]amino]-2,6-difluorophenyl]-2-oxoethyl]-1H-pyrrolo[2,3-b]pyridine;N-[3-[2-(2-ethynyl-1H-pyrrolo[2,3-b]pyridin-5-yl)acetyl]-2,4-difluorophenyl]propane-1-sulfonamide (PubChem CID 158207923) has the molecular formula C148H141Cl3F16N28O25S8
and a molecular weight of 3378.79 g/mol. Its IUPAC name is N-[2-chloro-4-fluoro-3-[2-(1H-pyrrolo[2,3-b]pyridin-5-yl)acetyl]phenyl]propane-1-sulfonamide;N-[2,4-dichloro-3-[2-(1H-pyrrolo[2,3-b]pyridin-5-yl)acetyl]phenyl]propane-1-sulfonamide;N-[2,4-difluoro-3-[2-[2-(hydroxymethyl)-1H-pyrrolo[2,3-b]pyridin-5-yl]acetyl]phenyl]propane-1-sulfonamide;1-[2,6-difluoro-3-(propylsulfamoylamino)phenyl]-2-(1H-pyrrolo[2,3-b]pyridin-5-yl)ethanone;2,6-difluoro-N-(1H-pyrrolo[2,3-b]pyridin-5-yl)-3-(2,2,2-trifluoroethylsulfonylamino)benzamide;N-[3-[2-[2-[(dimethylamino)methyl]-1H-pyrrolo[2,3-b]pyridin-5-yl]acetyl]-2,4-difluorophenyl]propane-1-sulfonamide;5-[2-[3-[[ethyl(methyl)sulfamoyl]amino]-2,6-difluorophenyl]-2-oxoethyl]-1H-pyrrolo[2,3-b]pyridine;N-[3-[2-(2-ethynyl-1H-pyrrolo[2,3-b]pyridin-5-yl)acetyl]-2,4-difluorophenyl]propane-1-sulfonamide.
Frequently Asked Questions
What is the IUPAC name of N-[2-chloro-4-fluoro-3-[2-(1H-pyrrolo[2,3-b]pyridin-5-yl)acetyl]phenyl]propane-1-sulfonamide;N-[2,4-dichloro-3-[2-(1H-pyrrolo[2,3-b]pyridin-5-yl)acetyl]phenyl]propane-1-sulfonamide;N-[2,4-difluoro-3-[2-[2-(hydroxymethyl)-1H-pyrrolo[2,3-b]pyridin-5-yl]acetyl]phenyl]propane-1-sulfonamide;1-[2,6-difluoro-3-(propylsulfamoylamino)phenyl]-2-(1H-pyrrolo[2,3-b]pyridin-5-yl)ethanone;2,6-difluoro-N-(1H-pyrrolo[2,3-b]pyridin-5-yl)-3-(2,2,2-trifluoroethylsulfonylamino)benzamide;N-[3-[2-[2-[(dimethylamino)methyl]-1H-pyrrolo[2,3-b]pyridin-5-yl]acetyl]-2,4-difluorophenyl]propane-1-sulfonamide;5-[2-[3-[[ethyl(methyl)sulfamoyl]amino]-2,6-difluorophenyl]-2-oxoethyl]-1H-pyrrolo[2,3-b]pyridine;N-[3-[2-(2-ethynyl-1H-pyrrolo[2,3-b]pyridin-5-yl)acetyl]-2,4-difluorophenyl]propane-1-sulfonamide?
The IUPAC name of N-[2-chloro-4-fluoro-3-[2-(1H-pyrrolo[2,3-b]pyridin-5-yl)acetyl]phenyl]propane-1-sulfonamide;N-[2,4-dichloro-3-[2-(1H-pyrrolo[2,3-b]pyridin-5-yl)acetyl]phenyl]propane-1-sulfonamide;N-[2,4-difluoro-3-[2-[2-(hydroxymethyl)-1H-pyrrolo[2,3-b]pyridin-5-yl]acetyl]phenyl]propane-1-sulfonamide;1-[2,6-difluoro-3-(propylsulfamoylamino)phenyl]-2-(1H-pyrrolo[2,3-b]pyridin-5-yl)ethanone;2,6-difluoro-N-(1H-pyrrolo[2,3-b]pyridin-5-yl)-3-(2,2,2-trifluoroethylsulfonylamino)benzamide;N-[3-[2-[2-[(dimethylamino)methyl]-1H-pyrrolo[2,3-b]pyridin-5-yl]acetyl]-2,4-difluorophenyl]propane-1-sulfonamide;5-[2-[3-[[ethyl(methyl)sulfamoyl]amino]-2,6-difluorophenyl]-2-oxoethyl]-1H-pyrrolo[2,3-b]pyridine;N-[3-[2-(2-ethynyl-1H-pyrrolo[2,3-b]pyridin-5-yl)acetyl]-2,4-difluorophenyl]propane-1-sulfonamide (CID 158207923) is N-[2-chloro-4-fluoro-3-[2-(1H-pyrrolo[2,3-b]pyridin-5-yl)acetyl]phenyl]propane-1-sulfonamide;N-[2,4-dichloro-3-[2-(1H-pyrrolo[2,3-b]pyridin-5-yl)acetyl]phenyl]propane-1-sulfonamide;N-[2,4-difluoro-3-[2-[2-(hydroxymethyl)-1H-pyrrolo[2,3-b]pyridin-5-yl]acetyl]phenyl]propane-1-sulfonamide;1-[2,6-difluoro-3-(propylsulfamoylamino)phenyl]-2-(1H-pyrrolo[2,3-b]pyridin-5-yl)ethanone;2,6-difluoro-N-(1H-pyrrolo[2,3-b]pyridin-5-yl)-3-(2,2,2-trifluoroethylsulfonylamino)benzamide;N-[3-[2-[2-[(dimethylamino)methyl]-1H-pyrrolo[2,3-b]pyridin-5-yl]acetyl]-2,4-difluorophenyl]propane-1-sulfonamide;5-[2-[3-[[ethyl(methyl)sulfamoyl]amino]-2,6-difluorophenyl]-2-oxoethyl]-1H-pyrrolo[2,3-b]pyridine;N-[3-[2-(2-ethynyl-1H-pyrrolo[2,3-b]pyridin-5-yl)acetyl]-2,4-difluorophenyl]propane-1-sulfonamide.
What is the SMILES notation for N-[2-chloro-4-fluoro-3-[2-(1H-pyrrolo[2,3-b]pyridin-5-yl)acetyl]phenyl]propane-1-sulfonamide;N-[2,4-dichloro-3-[2-(1H-pyrrolo[2,3-b]pyridin-5-yl)acetyl]phenyl]propane-1-sulfonamide;N-[2,4-difluoro-3-[2-[2-(hydroxymethyl)-1H-pyrrolo[2,3-b]pyridin-5-yl]acetyl]phenyl]propane-1-sulfonamide;1-[2,6-difluoro-3-(propylsulfamoylamino)phenyl]-2-(1H-pyrrolo[2,3-b]pyridin-5-yl)ethanone;2,6-difluoro-N-(1H-pyrrolo[2,3-b]pyridin-5-yl)-3-(2,2,2-trifluoroethylsulfonylamino)benzamide;N-[3-[2-[2-[(dimethylamino)methyl]-1H-pyrrolo[2,3-b]pyridin-5-yl]acetyl]-2,4-difluorophenyl]propane-1-sulfonamide;5-[2-[3-[[ethyl(methyl)sulfamoyl]amino]-2,6-difluorophenyl]-2-oxoethyl]-1H-pyrrolo[2,3-b]pyridine;N-[3-[2-(2-ethynyl-1H-pyrrolo[2,3-b]pyridin-5-yl)acetyl]-2,4-difluorophenyl]propane-1-sulfonamide?
The canonical SMILES for N-[2-chloro-4-fluoro-3-[2-(1H-pyrrolo[2,3-b]pyridin-5-yl)acetyl]phenyl]propane-1-sulfonamide;N-[2,4-dichloro-3-[2-(1H-pyrrolo[2,3-b]pyridin-5-yl)acetyl]phenyl]propane-1-sulfonamide;N-[2,4-difluoro-3-[2-[2-(hydroxymethyl)-1H-pyrrolo[2,3-b]pyridin-5-yl]acetyl]phenyl]propane-1-sulfonamide;1-[2,6-difluoro-3-(propylsulfamoylamino)phenyl]-2-(1H-pyrrolo[2,3-b]pyridin-5-yl)ethanone;2,6-difluoro-N-(1H-pyrrolo[2,3-b]pyridin-5-yl)-3-(2,2,2-trifluoroethylsulfonylamino)benzamide;N-[3-[2-[2-[(dimethylamino)methyl]-1H-pyrrolo[2,3-b]pyridin-5-yl]acetyl]-2,4-difluorophenyl]propane-1-sulfonamide;5-[2-[3-[[ethyl(methyl)sulfamoyl]amino]-2,6-difluorophenyl]-2-oxoethyl]-1H-pyrrolo[2,3-b]pyridine;N-[3-[2-(2-ethynyl-1H-pyrrolo[2,3-b]pyridin-5-yl)acetyl]-2,4-difluorophenyl]propane-1-sulfonamide is C#Cc1cc2cc(CC(=O)c3c(F)ccc(NS(=O)(=O)CCC)c3F)cnc2[nH]1.CCCNS(=O)(=O)Nc1ccc(F)c(C(=O)Cc2cnc3[nH]ccc3c2)c1F.CCCS(=O)(=O)Nc1ccc(Cl)c(C(=O)Cc2cnc3[nH]ccc3c2)c1Cl.CCCS(=O)(=O)Nc1ccc(F)c(C(=O)Cc2cnc3[nH]c(CN(C)C)cc3c2)c1F.CCCS(=O)(=O)Nc1ccc(F)c(C(=O)Cc2cnc3[nH]c(CO)cc3c2)c1F.CCCS(=O)(=O)Nc1ccc(F)c(C(=O)Cc2cnc3[nH]ccc3c2)c1Cl.CCN(C)S(=O)(=O)Nc1ccc(F)c(C(=O)Cc2cnc3[nH]ccc3c2)c1F.O=C(Nc1cnc2[nH]ccc2c1)c1c(F)ccc(NS(=O)(=O)CC(F)(F)F)c1F.
What is the InChIKey of N-[2-chloro-4-fluoro-3-[2-(1H-pyrrolo[2,3-b]pyridin-5-yl)acetyl]phenyl]propane-1-sulfonamide;N-[2,4-dichloro-3-[2-(1H-pyrrolo[2,3-b]pyridin-5-yl)acetyl]phenyl]propane-1-sulfonamide;N-[2,4-difluoro-3-[2-[2-(hydroxymethyl)-1H-pyrrolo[2,3-b]pyridin-5-yl]acetyl]phenyl]propane-1-sulfonamide;1-[2,6-difluoro-3-(propylsulfamoylamino)phenyl]-2-(1H-pyrrolo[2,3-b]pyridin-5-yl)ethanone;2,6-difluoro-N-(1H-pyrrolo[2,3-b]pyridin-5-yl)-3-(2,2,2-trifluoroethylsulfonylamino)benzamide;N-[3-[2-[2-[(dimethylamino)methyl]-1H-pyrrolo[2,3-b]pyridin-5-yl]acetyl]-2,4-difluorophenyl]propane-1-sulfonamide;5-[2-[3-[[ethyl(methyl)sulfamoyl]amino]-2,6-difluorophenyl]-2-oxoethyl]-1H-pyrrolo[2,3-b]pyridine;N-[3-[2-(2-ethynyl-1H-pyrrolo[2,3-b]pyridin-5-yl)acetyl]-2,4-difluorophenyl]propane-1-sulfonamide?
The InChIKey is GBSJGYPDPSEPSV-UHFFFAOYSA-N. The full InChI is InChI=1S/C21H24F2N4O3S.C20H17F2N3O3S.C19H19F2N3O4S.C18H17Cl2N3O3S.C18H17ClFN3O3S.2C18H18F2N4O3S.C16H11F5N4O3S/c1-4-7-31(29,30)26-17-6-5-16(22)19(20(17)23)18(28)9-13-8-14-10-15(12-27(2)3)25-21(14)24-11-13;1-3-7-29(27,28)25-16-6-5-15(21)18(19(16)22)17(26)9-12-8-13-10-14(4-2)24-20(13)23-11-12;1-2-5-29(27,28)24-15-4-3-14(20)17(18(15)21)16(26)7-11-6-12-8-13(10-25)23-19(12)22-9-11;1-2-7-27(25,26)23-14-4-3-13(19)16(17(14)20)15(24)9-11-8-12-5-6-21-18(12)22-10-11;1-2-7-27(25,26)23-14-4-3-13(20)16(17(14)19)15(24)9-11-8-12-5-6-21-18(12)22-10-11;1-3-24(2)28(26,27)23-14-5-4-13(19)16(17(14)20)15(25)9-11-8-12-6-7-21-18(12)22-10-11;1-2-6-23-28(26,27)24-14-4-3-13(19)16(17(14)20)15(25)9-11-8-12-5-7-21-18(12)22-10-11;17-10-1-2-11(25-29(27,28)7-16(19,20)21)13(18)12(10)15(26)24-9-5-8-3-4-22-14(8)23-6-9/h5-6,8,10-11,26H,4,7,9,12H2,1-3H3,(H,24,25);2,5-6,8,10-11,25H,3,7,9H2,1H3,(H,23,24);3-4,6,8-9,24-25H,2,5,7,10H2,1H3,(H,22,23);2*3-6,8,10,23H,2,7,9H2,1H3,(H,21,22);4-8,10,23H,3,9H2,1-2H3,(H,21,22);3-5,7-8,10,23-24H,2,6,9H2,1H3,(H,21,22);1-6,25H,7H2,(H,22,23)(H,24,26).
What are the key properties of N-[2-chloro-4-fluoro-3-[2-(1H-pyrrolo[2,3-b]pyridin-5-yl)acetyl]phenyl]propane-1-sulfonamide;N-[2,4-dichloro-3-[2-(1H-pyrrolo[2,3-b]pyridin-5-yl)acetyl]phenyl]propane-1-sulfonamide;N-[2,4-difluoro-3-[2-[2-(hydroxymethyl)-1H-pyrrolo[2,3-b]pyridin-5-yl]acetyl]phenyl]propane-1-sulfonamide;1-[2,6-difluoro-3-(propylsulfamoylamino)phenyl]-2-(1H-pyrrolo[2,3-b]pyridin-5-yl)ethanone;2,6-difluoro-N-(1H-pyrrolo[2,3-b]pyridin-5-yl)-3-(2,2,2-trifluoroethylsulfonylamino)benzamide;N-[3-[2-[2-[(dimethylamino)methyl]-1H-pyrrolo[2,3-b]pyridin-5-yl]acetyl]-2,4-difluorophenyl]propane-1-sulfonamide;5-[2-[3-[[ethyl(methyl)sulfamoyl]amino]-2,6-difluorophenyl]-2-oxoethyl]-1H-pyrrolo[2,3-b]pyridine;N-[3-[2-(2-ethynyl-1H-pyrrolo[2,3-b]pyridin-5-yl)acetyl]-2,4-difluorophenyl]propane-1-sulfonamide?
N-[2-chloro-4-fluoro-3-[2-(1H-pyrrolo[2,3-b]pyridin-5-yl)acetyl]phenyl]propane-1-sulfonamide;N-[2,4-dichloro-3-[2-(1H-pyrrolo[2,3-b]pyridin-5-yl)acetyl]phenyl]propane-1-sulfonamide;N-[2,4-difluoro-3-[2-[2-(hydroxymethyl)-1H-pyrrolo[2,3-b]pyridin-5-yl]acetyl]phenyl]propane-1-sulfonamide;1-[2,6-difluoro-3-(propylsulfamoylamino)phenyl]-2-(1H-pyrrolo[2,3-b]pyridin-5-yl)ethanone;2,6-difluoro-N-(1H-pyrrolo[2,3-b]pyridin-5-yl)-3-(2,2,2-trifluoroethylsulfonylamino)benzamide;N-[3-[2-[2-[(dimethylamino)methyl]-1H-pyrrolo[2,3-b]pyridin-5-yl]acetyl]-2,4-difluorophenyl]propane-1-sulfonamide;5-[2-[3-[[ethyl(methyl)sulfamoyl]amino]-2,6-difluorophenyl]-2-oxoethyl]-1H-pyrrolo[2,3-b]pyridine;N-[3-[2-(2-ethynyl-1H-pyrrolo[2,3-b]pyridin-5-yl)acetyl]-2,4-difluorophenyl]propane-1-sulfonamide has a molecular weight of 3378.79 g/mol, XLogP of 27.36, 58 rotatable bonds, 19 hydrogen bond donors, and 34 hydrogen bond acceptors.
Where does this data come from?
All data for N-[2-chloro-4-fluoro-3-[2-(1H-pyrrolo[2,3-b]pyridin-5-yl)acetyl]phenyl]propane-1-sulfonamide;N-[2,4-dichloro-3-[2-(1H-pyrrolo[2,3-b]pyridin-5-yl)acetyl]phenyl]propane-1-sulfonamide;N-[2,4-difluoro-3-[2-[2-(hydroxymethyl)-1H-pyrrolo[2,3-b]pyridin-5-yl]acetyl]phenyl]propane-1-sulfonamide;1-[2,6-difluoro-3-(propylsulfamoylamino)phenyl]-2-(1H-pyrrolo[2,3-b]pyridin-5-yl)ethanone;2,6-difluoro-N-(1H-pyrrolo[2,3-b]pyridin-5-yl)-3-(2,2,2-trifluoroethylsulfonylamino)benzamide;N-[3-[2-[2-[(dimethylamino)methyl]-1H-pyrrolo[2,3-b]pyridin-5-yl]acetyl]-2,4-difluorophenyl]propane-1-sulfonamide;5-[2-[3-[[ethyl(methyl)sulfamoyl]amino]-2,6-difluorophenyl]-2-oxoethyl]-1H-pyrrolo[2,3-b]pyridine;N-[3-[2-(2-ethynyl-1H-pyrrolo[2,3-b]pyridin-5-yl)acetyl]-2,4-difluorophenyl]propane-1-sulfonamide is sourced from PubChem (CID 158207923), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).