6-chloro-3-[(1S)-1-(3-ethoxy-4-methoxyphenyl)-2-methylsulfonylethyl]-1-(2,2,2-trifluoroethyl)imidazo[4,5-b]pyridin-2-one;6-(4,6-dimethylpyrimidin-5-yl)-3-[(1S)-1-(3-ethoxy-4-methoxyphenyl)-2-methylsulfonylethyl]-1H-imidazo[4,5-b]pyridin-2-one;3-[(1S)-1-(3-ethoxy-4-methoxyphenyl)-2-methylsulfonylethyl]-7-(2-fluorophenyl)-1H-imidazo[4,5-b]pyridin-2-one;3-[(1S)-1-(3-ethoxy-4-methoxyphenyl)-2-methylsulfonylethyl]-7-(1-methylpyrazol-4-yl)-1H-imidazo[4,5-b]pyridin-2-one;3-[(1S)-1-(3-ethoxy-4-methoxyphenyl)-2-methylsulfonylethyl]-6-(4-methylpyrimidin-5-yl)-1H-imidazo[4,5-b]pyridin-2-one

C113H122ClF4N21O25S5 — CID 160557735

IUPAC6-chloro-3-[(1S)-1-(3-ethoxy-4-methoxyphenyl)-2-methylsulfonylethyl]-1-(2,2,2-trifluoroethyl)imidazo[4,5-b]pyridin-2-one;6-(4,6-dimethylpyrimidin-5-yl)-3-[(1S)-1-(3-ethoxy-4-methoxyphenyl)-2-methylsulfonylethyl]-1H-imidazo[4,5-b]pyridin-2-one;3-[(1S)-1-(3-ethoxy-4-methoxyphenyl)-2-methylsulfonylethyl]-7-(2-fluorophenyl)-1H-imidazo[4,5-b]pyridin-2-one;3-[(1S)-1-(3-ethoxy-4-methoxyphenyl)-2-methylsulfonylethyl]-7-(1-methylpyrazol-4-yl)-1H-imidazo[4,5-b]pyridin-2-one;3-[(1S)-1-(3-ethoxy-4-methoxyphenyl)-2-methylsulfonylethyl]-6-(4-methylpyrimidin-5-yl)-1H-imidazo[4,5-b]pyridin-2-one
SMILESCCOc1cc([C@@H](CS(C)(=O)=O)n2c(=O)[nH]c3c(-c4ccccc4F)ccnc32)ccc1OC.CCOc1cc([C@@H](CS(C)(=O)=O)n2c(=O)[nH]c3c(-c4cnn(C)c4)ccnc32)ccc1OC.CCOc1cc([C@@H](CS(C)(=O)=O)n2c(=O)[nH]c3cc(-c4c(C)ncnc4C)cnc32)ccc1OC.CCOc1cc([C@@H](CS(C)(=O)=O)n2c(=O)[nH]c3cc(-c4cncnc4C)cnc32)ccc1OC.CCOc1cc([C@@H](CS(C)(=O)=O)n2c(=O)n(CC(F)(F)F)c3cc(Cl)cnc32)ccc1OC
InChIInChI=1S/C24H24FN3O5S.C24H27N5O5S.C23H25N5O5S.C22H25N5O5S.C20H21ClF3N3O5S/c1-4-33-21-13-15(9-10-20(21)32-2)19(14-34(3,30)31)28-23-22(27-24(28)29)17(11-12-26-23)16-7-5-6-8-18(16)25;1-6-34-21-10-16(7-8-20(21)33-4)19(12-35(5,31)32)29-23-18(28-24(29)30)9-17(11-25-23)22-14(2)26-13-27-15(22)3;1-5-33-21-9-15(6-7-20(21)32-3)19(12-34(4,30)31)28-22-18(27-23(28)29)8-16(10-25-22)17-11-24-13-26-14(17)2;1-5-32-19-10-14(6-7-18(19)31-3)17(13-33(4,29)30)27-21-20(25-22(27)28)16(8-9-23-21)15-11-24-26(2)12-15;1-4-32-17-7-12(5-6-16(17)31-2)15(10-33(3,29)30)27-18-14(8-13(21)9-25-18)26(19(27)28)11-20(22,23)24/h5-13,19H,4,14H2,1-3H3,(H,27,29);7-11,13,19H,6,12H2,1-5H3,(H,28,30);6-11,13,19H,5,12H2,1-4H3,(H,27,29);6-12,17H,5,13H2,1-4H3,(H,25,28);5-9,15H,4,10-11H2,1-3H3/t3*19-;17-;15-/m11111/s1
InChIKeyQYXGHSAHSCBHGW-FTKSJMTISA-N
MW2446.12 g/mol
LogP14.56
Rot. Bonds40

About 6-chloro-3-[(1S)-1-(3-ethoxy-4-methoxyphenyl)-2-methylsulfonylethyl]-1-(2,2,2-trifluoroethyl)imidazo[4,5-b]pyridin-2-one;6-(4,6-dimethylpyrimidin-5-yl)-3-[(1S)-1-(3-ethoxy-4-methoxyphenyl)-2-methylsulfonylethyl]-1H-imidazo[4,5-b]pyridin-2-one;3-[(1S)-1-(3-ethoxy-4-methoxyphenyl)-2-methylsulfonylethyl]-7-(2-fluorophenyl)-1H-imidazo[4,5-b]pyridin-2-one;3-[(1S)-1-(3-ethoxy-4-methoxyphenyl)-2-methylsulfonylethyl]-7-(1-methylpyrazol-4-yl)-1H-imidazo[4,5-b]pyridin-2-one;3-[(1S)-1-(3-ethoxy-4-methoxyphenyl)-2-methylsulfonylethyl]-6-(4-methylpyrimidin-5-yl)-1H-imidazo[4,5-b]pyridin-2-one

6-chloro-3-[(1S)-1-(3-ethoxy-4-methoxyphenyl)-2-methylsulfonylethyl]-1-(2,2,2-trifluoroethyl)imidazo[4,5-b]pyridin-2-one;6-(4,6-dimethylpyrimidin-5-yl)-3-[(1S)-1-(3-ethoxy-4-methoxyphenyl)-2-methylsulfonylethyl]-1H-imidazo[4,5-b]pyridin-2-one;3-[(1S)-1-(3-ethoxy-4-methoxyphenyl)-2-methylsulfonylethyl]-7-(2-fluorophenyl)-1H-imidazo[4,5-b]pyridin-2-one;3-[(1S)-1-(3-ethoxy-4-methoxyphenyl)-2-methylsulfonylethyl]-7-(1-methylpyrazol-4-yl)-1H-imidazo[4,5-b]pyridin-2-one;3-[(1S)-1-(3-ethoxy-4-methoxyphenyl)-2-methylsulfonylethyl]-6-(4-methylpyrimidin-5-yl)-1H-imidazo[4,5-b]pyridin-2-one (PubChem CID 160557735) has the molecular formula C113H122ClF4N21O25S5 and a molecular weight of 2446.12 g/mol. Its IUPAC name is 6-chloro-3-[(1S)-1-(3-ethoxy-4-methoxyphenyl)-2-methylsulfonylethyl]-1-(2,2,2-trifluoroethyl)imidazo[4,5-b]pyridin-2-one;6-(4,6-dimethylpyrimidin-5-yl)-3-[(1S)-1-(3-ethoxy-4-methoxyphenyl)-2-methylsulfonylethyl]-1H-imidazo[4,5-b]pyridin-2-one;3-[(1S)-1-(3-ethoxy-4-methoxyphenyl)-2-methylsulfonylethyl]-7-(2-fluorophenyl)-1H-imidazo[4,5-b]pyridin-2-one;3-[(1S)-1-(3-ethoxy-4-methoxyphenyl)-2-methylsulfonylethyl]-7-(1-methylpyrazol-4-yl)-1H-imidazo[4,5-b]pyridin-2-one;3-[(1S)-1-(3-ethoxy-4-methoxyphenyl)-2-methylsulfonylethyl]-6-(4-methylpyrimidin-5-yl)-1H-imidazo[4,5-b]pyridin-2-one.

Molecular Properties

Compound Name6-chloro-3-[(1S)-1-(3-ethoxy-4-methoxyphenyl)-2-methylsulfonylethyl]-1-(2,2,2-trifluoroethyl)imidazo[4,5-b]pyridin-2-one;6-(4,6-dimethylpyrimidin-5-yl)-3-[(1S)-1-(3-ethoxy-4-methoxyphenyl)-2-methylsulfonylethyl]-1H-imidazo[4,5-b]pyridin-2-one;3-[(1S)-1-(3-ethoxy-4-methoxyphenyl)-2-methylsulfonylethyl]-7-(2-fluorophenyl)-1H-imidazo[4,5-b]pyridin-2-one;3-[(1S)-1-(3-ethoxy-4-methoxyphenyl)-2-methylsulfonylethyl]-7-(1-methylpyrazol-4-yl)-1H-imidazo[4,5-b]pyridin-2-one;3-[(1S)-1-(3-ethoxy-4-methoxyphenyl)-2-methylsulfonylethyl]-6-(4-methylpyrimidin-5-yl)-1H-imidazo[4,5-b]pyridin-2-one
PubChem CID160557735
Molecular FormulaC113H122ClF4N21O25S5
Molecular Weight2446.12 g/mol
Exact Mass2443.71
IUPAC Name6-chloro-3-[(1S)-1-(3-ethoxy-4-methoxyphenyl)-2-methylsulfonylethyl]-1-(2,2,2-trifluoroethyl)imidazo[4,5-b]pyridin-2-one;6-(4,6-dimethylpyrimidin-5-yl)-3-[(1S)-1-(3-ethoxy-4-methoxyphenyl)-2-methylsulfonylethyl]-1H-imidazo[4,5-b]pyridin-2-one;3-[(1S)-1-(3-ethoxy-4-methoxyphenyl)-2-methylsulfonylethyl]-7-(2-fluorophenyl)-1H-imidazo[4,5-b]pyridin-2-one;3-[(1S)-1-(3-ethoxy-4-methoxyphenyl)-2-methylsulfonylethyl]-7-(1-methylpyrazol-4-yl)-1H-imidazo[4,5-b]pyridin-2-one;3-[(1S)-1-(3-ethoxy-4-methoxyphenyl)-2-methylsulfonylethyl]-6-(4-methylpyrimidin-5-yl)-1H-imidazo[4,5-b]pyridin-2-one
SMILESCCOc1cc([C@@H](CS(C)(=O)=O)n2c(=O)[nH]c3c(-c4ccccc4F)ccnc32)ccc1OC.CCOc1cc([C@@H](CS(C)(=O)=O)n2c(=O)[nH]c3c(-c4cnn(C)c4)ccnc32)ccc1OC.CCOc1cc([C@@H](CS(C)(=O)=O)n2c(=O)[nH]c3cc(-c4c(C)ncnc4C)cnc32)ccc1OC.CCOc1cc([C@@H](CS(C)(=O)=O)n2c(=O)[nH]c3cc(-c4cncnc4C)cnc32)ccc1OC.CCOc1cc([C@@H](CS(C)(=O)=O)n2c(=O)n(CC(F)(F)F)c3cc(Cl)cnc32)ccc1OC
InChIInChI=1S/C24H24FN3O5S.C24H27N5O5S.C23H25N5O5S.C22H25N5O5S.C20H21ClF3N3O5S/c1-4-33-21-13-15(9-10-20(21)32-2)19(14-34(3,30)31)28-23-22(27-24(28)29)17(11-12-26-23)16-7-5-6-8-18(16)25;1-6-34-21-10-16(7-8-20(21)33-4)19(12-35(5,31)32)29-23-18(28-24(29)30)9-17(11-25-23)22-14(2)26-13-27-15(22)3;1-5-33-21-9-15(6-7-20(21)32-3)19(12-34(4,30)31)28-22-18(27-23(28)29)8-16(10-25-22)17-11-24-13-26-14(17)2;1-5-32-19-10-14(6-7-18(19)31-3)17(13-33(4,29)30)27-21-20(25-22(27)28)16(8-9-23-21)15-11-24-26(2)12-15;1-4-32-17-7-12(5-6-16(17)31-2)15(10-33(3,29)30)27-18-14(8-13(21)9-25-18)26(19(27)28)11-20(22,23)24/h5-13,19H,4,14H2,1-3H3,(H,27,29);7-11,13,19H,6,12H2,1-5H3,(H,28,30);6-11,13,19H,5,12H2,1-4H3,(H,27,29);6-12,17H,5,13H2,1-4H3,(H,25,28);5-9,15H,4,10-11H2,1-3H3/t3*19-;17-;15-/m11111/s1
InChIKeyQYXGHSAHSCBHGW-FTKSJMTISA-N
XLogP14.56
TPSA574.92 Ų
H-Bond Donors4
H-Bond Acceptors42
Rotatable Bonds40
Heavy Atoms169
Complexity—

Lipinski Rule of Five

3 violations

RuleValue
MW ≤ 5002446.12
LogP ≤ 514.56
H-Bond Donors ≤ 54
H-Bond Acceptors ≤ 1042

Analyze 6-chloro-3-[(1S)-1-(3-ethoxy-4-methoxyphenyl)-2-methylsulfonylethyl]-1-(2,2,2-trifluoroethyl)imidazo[4,5-b]pyridin-2-one;6-(4,6-dimethylpyrimidin-5-yl)-3-[(1S)-1-(3-ethoxy-4-methoxyphenyl)-2-methylsulfonylethyl]-1H-imidazo[4,5-b]pyridin-2-one;3-[(1S)-1-(3-ethoxy-4-methoxyphenyl)-2-methylsulfonylethyl]-7-(2-fluorophenyl)-1H-imidazo[4,5-b]pyridin-2-one;3-[(1S)-1-(3-ethoxy-4-methoxyphenyl)-2-methylsulfonylethyl]-7-(1-methylpyrazol-4-yl)-1H-imidazo[4,5-b]pyridin-2-one;3-[(1S)-1-(3-ethoxy-4-methoxyphenyl)-2-methylsulfonylethyl]-6-(4-methylpyrimidin-5-yl)-1H-imidazo[4,5-b]pyridin-2-one with MolForge

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Related Compounds

3-[(1S)-1-[4-(difluoromethoxy)-3-[2-[3-[3-[(1S)-1-[4-(difluoromethoxy)-3-ethoxyphenyl]-2-methylsulfonylethyl]-2-oxo-1H-imidazo[4,5-b]pyridin-6-yl]-2-fluorophenyl]ethoxy]phenyl]-2-methylsulfonylethyl]-6-[3-[2-[2-(difluoromethoxy)-5-[(1S)-1-[6-(2-fluorophenyl)-7-methyl-2-oxo-1H-imidazo[4,5-b]pyridin-3-yl]-2-methylsulfonylethyl]phenoxy]ethyl]phenyl]-7-methyl-1H-imidazo[4,5-b]pyridin-2-one
CID 138737024
6-[3-[[5-[1-[6-[2-chloro-4-[[2-methoxy-5-[1-[6-(2-methylphenyl)-2-oxo-1H-imidazo[4,5-b]pyridin-3-yl]-2-methylsulfonylethyl]phenoxy]methyl]phenyl]-2-oxo-1H-imidazo[4,5-b]pyridin-3-yl]-2-methylsulfonylethyl]-2-methoxyphenoxy]methyl]-2-fluorophenyl]-3-[1-(3-ethoxy-4-methoxyphenyl)-2-methylsulfonylethyl]-1-methylimidazo[4,5-b]pyridin-2-one
CID 138737075
3-[1-[4-(difluoromethoxy)-3-[2-[3-[3-[1-[4-(difluoromethoxy)-3-ethoxyphenyl]-2-methylsulfonylethyl]-2-oxo-1H-imidazo[4,5-b]pyridin-6-yl]-2-fluorophenyl]ethoxy]phenyl]-2-methylsulfonylethyl]-6-[3-[2-[2-(difluoromethoxy)-5-[1-[6-(2-fluorophenyl)-7-methyl-2-oxo-1H-imidazo[4,5-b]pyridin-3-yl]-2-methylsulfonylethyl]phenoxy]ethyl]phenyl]-7-methyl-1H-imidazo[4,5-b]pyridin-2-one
CID 138737076
3-[(1R)-1-[4-(difluoromethoxy)-3-[2-[3-[3-[(1R)-1-[4-(difluoromethoxy)-3-ethoxyphenyl]-2-methylsulfonylethyl]-2-oxo-1H-imidazo[4,5-b]pyridin-6-yl]-2-fluorophenyl]ethoxy]phenyl]-2-methylsulfonylethyl]-6-[3-[2-[2-(difluoromethoxy)-5-[(1R)-1-[6-(2-fluorophenyl)-7-methyl-2-oxo-1H-imidazo[4,5-b]pyridin-3-yl]-2-methylsulfonylethyl]phenoxy]ethyl]phenyl]-7-methyl-1H-imidazo[4,5-b]pyridin-2-one
CID 138737108
3-(2,2-difluoro-1,3-benzodioxol-5-yl)-5-[1-(1-ethylsulfonylpiperidin-4-yl)pyrazol-4-yl]-1H-pyrrolo[2,3-b]pyridine;3-(2,2-difluoro-1,3-benzodioxol-5-yl)-5-[4-(4-methylsulfonylpiperazin-1-yl)pyrazol-1-yl]-1H-pyrrolo[2,3-b]pyridine;3-(2,2-difluoro-1,3-benzodioxol-5-yl)-5-[1-(1-methylsulfonylpiperidin-4-yl)pyrazol-4-yl]-1H-pyrrolo[2,3-b]pyridine;3-(2,2-difluoro-1,3-benzodioxol-5-yl)-5-[1-(1-propylsulfonylpiperidin-4-yl)pyrazol-4-yl]-1H-pyrrolo[2,3-b]pyridine;2-[4-[1-[3-(2,2-difluoro-1,3-benzodioxol-5-yl)-1H-pyrrolo[2,3-b]pyridin-5-yl]pyrazol-4-yl]piperazin-1-yl]ethanol;2-[4-[4-[3-(3,5-difluoro-2-methoxyphenyl)-1H-pyrrolo[2,3-b]pyridin-5-yl]pyrazol-1-yl]piperidin-1-yl]ethanol
CID 157223539
7-chloro-3-[(1S)-1-(3-ethoxy-4-methoxyphenyl)-2-methylsulfonylethyl]-1H-benzimidazol-2-one;4-chloro-1-[(1S)-1-(3-ethoxy-4-methoxyphenyl)-2-methylsulfonylethyl]-3-(2,2,2-trifluoroethyl)benzimidazol-2-one;6-(3-cyclopropylpyrazin-2-yl)-3-[(1S)-1-(3-ethoxy-4-methoxyphenyl)-2-methylsulfonylethyl]-1H-benzimidazol-2-one;6-[3-(dimethylamino)pyrazin-2-yl]-3-[(1S)-1-(3-ethoxy-4-methoxyphenyl)-2-methylsulfonylethyl]-1H-benzimidazol-2-one;3-[(1S)-1-(3-ethoxy-4-methoxyphenyl)-2-methylsulfonylethyl]-4-fluoro-1-[(2-fluorophenyl)methyl]-6-(trifluoromethyl)benzimidazol-2-one
CID 157761497
4-[[3-(3-chlorophenyl)imidazo[1,2-b]pyridazin-6-yl]amino]cyclohexane-1-carboximidamide;N-[4-[[3-(3-chlorophenyl)imidazo[1,2-b]pyridazin-6-yl]amino]cyclohexylidene]hydroxylamine;3-(3-chlorophenyl)-N-[4-(isocyanomethyl)cyclohexyl]imidazo[1,2-b]pyridazin-6-amine;3-(3-fluorophenyl)-N-[4-(methylsulfonylmethyl)cyclohexyl]imidazo[1,2-b]pyridazin-6-amine;N-[4-(methylsulfonylmethyl)cyclohexyl]-3-[3-(trifluoromethoxy)phenyl]imidazo[1,2-b]pyridazin-6-amine;N-[4-(methylsulfonylmethyl)cyclohexyl]-3-[3-(trifluoromethyl)phenyl]imidazo[1,2-b]pyridazin-6-amine;4-[[3-[3-(trifluoromethoxy)phenyl]pyrazolo[1,5-a]pyrimidin-5-yl]amino]cyclohexan-1-ol
CID 159736673
3-(2,2-difluoro-1,3-benzodioxol-5-yl)-5-[1-(1-ethylsulfonylpiperidin-4-yl)pyrazol-4-yl]-1H-pyrrolo[2,3-b]pyridine;3-(2,2-difluoro-1,3-benzodioxol-5-yl)-5-[1-(4-methylpiperazin-1-yl)sulfonylpyrazol-4-yl]-1H-pyrrolo[2,3-b]pyridine;3-(2,2-difluoro-1,3-benzodioxol-5-yl)-5-[1-(1-methylpiperidin-4-yl)pyrazol-4-yl]-1H-pyrrolo[2,3-b]pyridine;3-(2,2-difluoro-1,3-benzodioxol-5-yl)-5-[1-(1-methylsulfonylpiperidin-4-yl)pyrazol-4-yl]-1H-pyrrolo[2,3-b]pyridine;3-(3,5-difluoro-2-methoxyphenyl)-5-[4-(4-methylsulfonylpiperazin-1-yl)pyrazol-1-yl]-1H-pyrrolo[2,3-b]pyridine;2-[4-[1-[3-(3,5-difluoro-2-methoxyphenyl)-1H-pyrrolo[2,3-b]pyridin-5-yl]pyrazol-4-yl]piperazin-1-yl]ethanol
CID 159827524
3-(2,2-difluoro-1,3-benzodioxol-5-yl)-5-[1-(1-ethylsulfonylpiperidin-4-yl)pyrazol-4-yl]-1H-pyrrolo[2,3-b]pyridine;3-(2,2-difluoro-1,3-benzodioxol-5-yl)-5-[1-(1-methylpiperidin-4-yl)pyrazol-4-yl]-1H-pyrrolo[2,3-b]pyridine;3-(2,2-difluoro-1,3-benzodioxol-5-yl)-5-[4-(4-methylsulfonylpiperazin-1-yl)pyrazol-1-yl]-1H-pyrrolo[2,3-b]pyridine;3-(2,2-difluoro-1,3-benzodioxol-5-yl)-5-[1-(1-methylsulfonylpiperidin-4-yl)pyrazol-4-yl]-1H-pyrrolo[2,3-b]pyridine;3-(2,2-difluoro-1,3-benzodioxol-5-yl)-5-[1-(1-propylsulfonylpiperidin-4-yl)pyrazol-4-yl]-1H-pyrrolo[2,3-b]pyridine
CID 159836588
6-chloro-3-[(1R)-1-(3-ethoxy-4-methoxyphenyl)-2-methylsulfonylethyl]-1-(2,2,2-trifluoroethyl)imidazo[4,5-b]pyridin-2-one;6-(4,6-dimethylpyrimidin-5-yl)-3-[(1R)-1-(3-ethoxy-4-methoxyphenyl)-2-methylsulfonylethyl]-1H-imidazo[4,5-b]pyridin-2-one;3-[(1R)-1-(3-ethoxy-4-methoxyphenyl)-2-methylsulfonylethyl]-7-(2-fluorophenyl)-1H-imidazo[4,5-b]pyridin-2-one;3-[(1R)-1-(3-ethoxy-4-methoxyphenyl)-2-methylsulfonylethyl]-7-(1-methylpyrazol-4-yl)-1H-imidazo[4,5-b]pyridin-2-one;3-[(1R)-1-(3-ethoxy-4-methoxyphenyl)-2-methylsulfonylethyl]-6-(4-methylpyrimidin-5-yl)-1H-imidazo[4,5-b]pyridin-2-one
CID 160557734
6-chloro-3-[1-(3-ethoxy-4-methoxyphenyl)-2-methylsulfonylethyl]-1-(2,2,2-trifluoroethyl)imidazo[4,5-b]pyridin-2-one;6-(4,6-dimethylpyrimidin-5-yl)-3-[1-(3-ethoxy-4-methoxyphenyl)-2-methylsulfonylethyl]-1H-imidazo[4,5-b]pyridin-2-one;3-[1-(3-ethoxy-4-methoxyphenyl)-2-methylsulfonylethyl]-7-(2-fluorophenyl)-1H-imidazo[4,5-b]pyridin-2-one;3-[1-(3-ethoxy-4-methoxyphenyl)-2-methylsulfonylethyl]-7-(1-methylpyrazol-4-yl)-1H-imidazo[4,5-b]pyridin-2-one;3-[1-(3-ethoxy-4-methoxyphenyl)-2-methylsulfonylethyl]-6-(4-methylpyrimidin-5-yl)-1H-imidazo[4,5-b]pyridin-2-one
CID 160557736
1-(4-chlorophenyl)-5-methyl-N-[(1S)-1-(2-methylsulfonyl-4-pyridinyl)butyl]-6,7-dihydro-5H-pyrazolo[4,5-b]pyridine-4-carboxamide;1-(4-fluorophenyl)-N-[(1S)-1-(4-methoxy-3-methylsulfonylphenyl)butyl]-5-(trifluoromethyl)-6,7-dihydro-5H-pyrazolo[4,5-b]pyridine-4-carboxamide;1-(4-fluorophenyl)-N-[(1S)-1-(6-methylsulfonyl-1H-pyrazolo[5,4-b]pyridin-4-yl)butyl]-5-(trifluoromethyl)-6,7-dihydro-5H-pyrazolo[4,5-b]pyridine-4-carboxamide;1-(4-fluorophenyl)-N-[(1S)-1-(6-methylsulfonyl-2-pyridinyl)butyl]-5-(trifluoromethyl)-6,7-dihydro-5H-pyrazolo[4,5-b]pyridine-4-carboxamide
CID 161431307

Frequently Asked Questions

What is the IUPAC name of 6-chloro-3-[(1S)-1-(3-ethoxy-4-methoxyphenyl)-2-methylsulfonylethyl]-1-(2,2,2-trifluoroethyl)imidazo[4,5-b]pyridin-2-one;6-(4,6-dimethylpyrimidin-5-yl)-3-[(1S)-1-(3-ethoxy-4-methoxyphenyl)-2-methylsulfonylethyl]-1H-imidazo[4,5-b]pyridin-2-one;3-[(1S)-1-(3-ethoxy-4-methoxyphenyl)-2-methylsulfonylethyl]-7-(2-fluorophenyl)-1H-imidazo[4,5-b]pyridin-2-one;3-[(1S)-1-(3-ethoxy-4-methoxyphenyl)-2-methylsulfonylethyl]-7-(1-methylpyrazol-4-yl)-1H-imidazo[4,5-b]pyridin-2-one;3-[(1S)-1-(3-ethoxy-4-methoxyphenyl)-2-methylsulfonylethyl]-6-(4-methylpyrimidin-5-yl)-1H-imidazo[4,5-b]pyridin-2-one?
The IUPAC name of 6-chloro-3-[(1S)-1-(3-ethoxy-4-methoxyphenyl)-2-methylsulfonylethyl]-1-(2,2,2-trifluoroethyl)imidazo[4,5-b]pyridin-2-one;6-(4,6-dimethylpyrimidin-5-yl)-3-[(1S)-1-(3-ethoxy-4-methoxyphenyl)-2-methylsulfonylethyl]-1H-imidazo[4,5-b]pyridin-2-one;3-[(1S)-1-(3-ethoxy-4-methoxyphenyl)-2-methylsulfonylethyl]-7-(2-fluorophenyl)-1H-imidazo[4,5-b]pyridin-2-one;3-[(1S)-1-(3-ethoxy-4-methoxyphenyl)-2-methylsulfonylethyl]-7-(1-methylpyrazol-4-yl)-1H-imidazo[4,5-b]pyridin-2-one;3-[(1S)-1-(3-ethoxy-4-methoxyphenyl)-2-methylsulfonylethyl]-6-(4-methylpyrimidin-5-yl)-1H-imidazo[4,5-b]pyridin-2-one (CID 160557735) is 6-chloro-3-[(1S)-1-(3-ethoxy-4-methoxyphenyl)-2-methylsulfonylethyl]-1-(2,2,2-trifluoroethyl)imidazo[4,5-b]pyridin-2-one;6-(4,6-dimethylpyrimidin-5-yl)-3-[(1S)-1-(3-ethoxy-4-methoxyphenyl)-2-methylsulfonylethyl]-1H-imidazo[4,5-b]pyridin-2-one;3-[(1S)-1-(3-ethoxy-4-methoxyphenyl)-2-methylsulfonylethyl]-7-(2-fluorophenyl)-1H-imidazo[4,5-b]pyridin-2-one;3-[(1S)-1-(3-ethoxy-4-methoxyphenyl)-2-methylsulfonylethyl]-7-(1-methylpyrazol-4-yl)-1H-imidazo[4,5-b]pyridin-2-one;3-[(1S)-1-(3-ethoxy-4-methoxyphenyl)-2-methylsulfonylethyl]-6-(4-methylpyrimidin-5-yl)-1H-imidazo[4,5-b]pyridin-2-one.
What is the SMILES notation for 6-chloro-3-[(1S)-1-(3-ethoxy-4-methoxyphenyl)-2-methylsulfonylethyl]-1-(2,2,2-trifluoroethyl)imidazo[4,5-b]pyridin-2-one;6-(4,6-dimethylpyrimidin-5-yl)-3-[(1S)-1-(3-ethoxy-4-methoxyphenyl)-2-methylsulfonylethyl]-1H-imidazo[4,5-b]pyridin-2-one;3-[(1S)-1-(3-ethoxy-4-methoxyphenyl)-2-methylsulfonylethyl]-7-(2-fluorophenyl)-1H-imidazo[4,5-b]pyridin-2-one;3-[(1S)-1-(3-ethoxy-4-methoxyphenyl)-2-methylsulfonylethyl]-7-(1-methylpyrazol-4-yl)-1H-imidazo[4,5-b]pyridin-2-one;3-[(1S)-1-(3-ethoxy-4-methoxyphenyl)-2-methylsulfonylethyl]-6-(4-methylpyrimidin-5-yl)-1H-imidazo[4,5-b]pyridin-2-one?
The canonical SMILES for 6-chloro-3-[(1S)-1-(3-ethoxy-4-methoxyphenyl)-2-methylsulfonylethyl]-1-(2,2,2-trifluoroethyl)imidazo[4,5-b]pyridin-2-one;6-(4,6-dimethylpyrimidin-5-yl)-3-[(1S)-1-(3-ethoxy-4-methoxyphenyl)-2-methylsulfonylethyl]-1H-imidazo[4,5-b]pyridin-2-one;3-[(1S)-1-(3-ethoxy-4-methoxyphenyl)-2-methylsulfonylethyl]-7-(2-fluorophenyl)-1H-imidazo[4,5-b]pyridin-2-one;3-[(1S)-1-(3-ethoxy-4-methoxyphenyl)-2-methylsulfonylethyl]-7-(1-methylpyrazol-4-yl)-1H-imidazo[4,5-b]pyridin-2-one;3-[(1S)-1-(3-ethoxy-4-methoxyphenyl)-2-methylsulfonylethyl]-6-(4-methylpyrimidin-5-yl)-1H-imidazo[4,5-b]pyridin-2-one is CCOc1cc([C@@H](CS(C)(=O)=O)n2c(=O)[nH]c3c(-c4ccccc4F)ccnc32)ccc1OC.CCOc1cc([C@@H](CS(C)(=O)=O)n2c(=O)[nH]c3c(-c4cnn(C)c4)ccnc32)ccc1OC.CCOc1cc([C@@H](CS(C)(=O)=O)n2c(=O)[nH]c3cc(-c4c(C)ncnc4C)cnc32)ccc1OC.CCOc1cc([C@@H](CS(C)(=O)=O)n2c(=O)[nH]c3cc(-c4cncnc4C)cnc32)ccc1OC.CCOc1cc([C@@H](CS(C)(=O)=O)n2c(=O)n(CC(F)(F)F)c3cc(Cl)cnc32)ccc1OC.
What is the InChIKey of 6-chloro-3-[(1S)-1-(3-ethoxy-4-methoxyphenyl)-2-methylsulfonylethyl]-1-(2,2,2-trifluoroethyl)imidazo[4,5-b]pyridin-2-one;6-(4,6-dimethylpyrimidin-5-yl)-3-[(1S)-1-(3-ethoxy-4-methoxyphenyl)-2-methylsulfonylethyl]-1H-imidazo[4,5-b]pyridin-2-one;3-[(1S)-1-(3-ethoxy-4-methoxyphenyl)-2-methylsulfonylethyl]-7-(2-fluorophenyl)-1H-imidazo[4,5-b]pyridin-2-one;3-[(1S)-1-(3-ethoxy-4-methoxyphenyl)-2-methylsulfonylethyl]-7-(1-methylpyrazol-4-yl)-1H-imidazo[4,5-b]pyridin-2-one;3-[(1S)-1-(3-ethoxy-4-methoxyphenyl)-2-methylsulfonylethyl]-6-(4-methylpyrimidin-5-yl)-1H-imidazo[4,5-b]pyridin-2-one?
The InChIKey is QYXGHSAHSCBHGW-FTKSJMTISA-N. The full InChI is InChI=1S/C24H24FN3O5S.C24H27N5O5S.C23H25N5O5S.C22H25N5O5S.C20H21ClF3N3O5S/c1-4-33-21-13-15(9-10-20(21)32-2)19(14-34(3,30)31)28-23-22(27-24(28)29)17(11-12-26-23)16-7-5-6-8-18(16)25;1-6-34-21-10-16(7-8-20(21)33-4)19(12-35(5,31)32)29-23-18(28-24(29)30)9-17(11-25-23)22-14(2)26-13-27-15(22)3;1-5-33-21-9-15(6-7-20(21)32-3)19(12-34(4,30)31)28-22-18(27-23(28)29)8-16(10-25-22)17-11-24-13-26-14(17)2;1-5-32-19-10-14(6-7-18(19)31-3)17(13-33(4,29)30)27-21-20(25-22(27)28)16(8-9-23-21)15-11-24-26(2)12-15;1-4-32-17-7-12(5-6-16(17)31-2)15(10-33(3,29)30)27-18-14(8-13(21)9-25-18)26(19(27)28)11-20(22,23)24/h5-13,19H,4,14H2,1-3H3,(H,27,29);7-11,13,19H,6,12H2,1-5H3,(H,28,30);6-11,13,19H,5,12H2,1-4H3,(H,27,29);6-12,17H,5,13H2,1-4H3,(H,25,28);5-9,15H,4,10-11H2,1-3H3/t3*19-;17-;15-/m11111/s1.
What are the key properties of 6-chloro-3-[(1S)-1-(3-ethoxy-4-methoxyphenyl)-2-methylsulfonylethyl]-1-(2,2,2-trifluoroethyl)imidazo[4,5-b]pyridin-2-one;6-(4,6-dimethylpyrimidin-5-yl)-3-[(1S)-1-(3-ethoxy-4-methoxyphenyl)-2-methylsulfonylethyl]-1H-imidazo[4,5-b]pyridin-2-one;3-[(1S)-1-(3-ethoxy-4-methoxyphenyl)-2-methylsulfonylethyl]-7-(2-fluorophenyl)-1H-imidazo[4,5-b]pyridin-2-one;3-[(1S)-1-(3-ethoxy-4-methoxyphenyl)-2-methylsulfonylethyl]-7-(1-methylpyrazol-4-yl)-1H-imidazo[4,5-b]pyridin-2-one;3-[(1S)-1-(3-ethoxy-4-methoxyphenyl)-2-methylsulfonylethyl]-6-(4-methylpyrimidin-5-yl)-1H-imidazo[4,5-b]pyridin-2-one?
6-chloro-3-[(1S)-1-(3-ethoxy-4-methoxyphenyl)-2-methylsulfonylethyl]-1-(2,2,2-trifluoroethyl)imidazo[4,5-b]pyridin-2-one;6-(4,6-dimethylpyrimidin-5-yl)-3-[(1S)-1-(3-ethoxy-4-methoxyphenyl)-2-methylsulfonylethyl]-1H-imidazo[4,5-b]pyridin-2-one;3-[(1S)-1-(3-ethoxy-4-methoxyphenyl)-2-methylsulfonylethyl]-7-(2-fluorophenyl)-1H-imidazo[4,5-b]pyridin-2-one;3-[(1S)-1-(3-ethoxy-4-methoxyphenyl)-2-methylsulfonylethyl]-7-(1-methylpyrazol-4-yl)-1H-imidazo[4,5-b]pyridin-2-one;3-[(1S)-1-(3-ethoxy-4-methoxyphenyl)-2-methylsulfonylethyl]-6-(4-methylpyrimidin-5-yl)-1H-imidazo[4,5-b]pyridin-2-one has a molecular weight of 2446.12 g/mol, XLogP of 14.56, 40 rotatable bonds, 4 hydrogen bond donors, and 42 hydrogen bond acceptors.
Where does this data come from?
All data for 6-chloro-3-[(1S)-1-(3-ethoxy-4-methoxyphenyl)-2-methylsulfonylethyl]-1-(2,2,2-trifluoroethyl)imidazo[4,5-b]pyridin-2-one;6-(4,6-dimethylpyrimidin-5-yl)-3-[(1S)-1-(3-ethoxy-4-methoxyphenyl)-2-methylsulfonylethyl]-1H-imidazo[4,5-b]pyridin-2-one;3-[(1S)-1-(3-ethoxy-4-methoxyphenyl)-2-methylsulfonylethyl]-7-(2-fluorophenyl)-1H-imidazo[4,5-b]pyridin-2-one;3-[(1S)-1-(3-ethoxy-4-methoxyphenyl)-2-methylsulfonylethyl]-7-(1-methylpyrazol-4-yl)-1H-imidazo[4,5-b]pyridin-2-one;3-[(1S)-1-(3-ethoxy-4-methoxyphenyl)-2-methylsulfonylethyl]-6-(4-methylpyrimidin-5-yl)-1H-imidazo[4,5-b]pyridin-2-one is sourced from PubChem (CID 160557735), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).