methane;6-(4-methylsulfonylphenyl)-1-phenylpyrrolo[2,3-b]pyridine;2-[[3-(4-methylsulfonylphenyl)pyrrolo[2,3-b]pyrazin-5-yl]methyl]-1,3-thiazole;6-(4-methylsulfonylphenyl)-1-(thiophen-2-ylmethyl)-2,3-dihydropyrrolo[2,3-b]pyridine;5-(4-methylsulfonylphenyl)-3-(thiophen-2-ylmethyl)imidazo[4,5-b]pyridine;2-(4-methylsulfonylphenyl)-9-(thiophen-2-ylmethyl)purine;6-(4-methylsulfonylphenyl)-1-(thiophen-2-ylmethyl)pyrazolo[3,4-b]pyrazine;6-(4-methylsulfonylphenyl)-1-(thiophen-2-ylmethyl)-3H-pyrrolo[2,3-b]pyridin-2-one

C134H135N21O15S13 — CID 167645055

IUPACmethane;6-(4-methylsulfonylphenyl)-1-phenylpyrrolo[2,3-b]pyridine;2-[[3-(4-methylsulfonylphenyl)pyrrolo[2,3-b]pyrazin-5-yl]methyl]-1,3-thiazole;6-(4-methylsulfonylphenyl)-1-(thiophen-2-ylmethyl)-2,3-dihydropyrrolo[2,3-b]pyridine;5-(4-methylsulfonylphenyl)-3-(thiophen-2-ylmethyl)imidazo[4,5-b]pyridine;2-(4-methylsulfonylphenyl)-9-(thiophen-2-ylmethyl)purine;6-(4-methylsulfonylphenyl)-1-(thiophen-2-ylmethyl)pyrazolo[3,4-b]pyrazine;6-(4-methylsulfonylphenyl)-1-(thiophen-2-ylmethyl)-3H-pyrrolo[2,3-b]pyridin-2-one
SMILESC.C.C.C.C.C.C.CS(=O)(=O)c1ccc(-c2ccc3c(n2)N(Cc2cccs2)C(=O)C3)cc1.CS(=O)(=O)c1ccc(-c2ccc3c(n2)N(Cc2cccs2)CC3)cc1.CS(=O)(=O)c1ccc(-c2ccc3ccn(-c4ccccc4)c3n2)cc1.CS(=O)(=O)c1ccc(-c2ccc3ncn(Cc4cccs4)c3n2)cc1.CS(=O)(=O)c1ccc(-c2cnc3ccn(Cc4nccs4)c3n2)cc1.CS(=O)(=O)c1ccc(-c2cnc3cnn(Cc4cccs4)c3n2)cc1.CS(=O)(=O)c1ccc(-c2ncc3ncn(Cc4cccs4)c3n2)cc1
InChIInChI=1S/C20H16N2O2S.C19H16N2O3S2.C19H18N2O2S2.C18H15N3O2S2.3C17H14N4O2S2.7CH4/c1-25(23,24)18-10-7-15(8-11-18)19-12-9-16-13-14-22(20(16)21-19)17-5-3-2-4-6-17;1-26(23,24)16-7-4-13(5-8-16)17-9-6-14-11-18(22)21(19(14)20-17)12-15-3-2-10-25-15;1-25(22,23)17-7-4-14(5-8-17)18-9-6-15-10-11-21(19(15)20-18)13-16-3-2-12-24-16;1-25(22,23)15-6-4-13(5-7-15)16-8-9-17-18(20-16)21(12-19-17)11-14-3-2-10-24-14;1-25(22,23)13-4-2-12(3-5-13)15-10-19-14-6-8-21(17(14)20-15)11-16-18-7-9-24-16;1-25(22,23)14-6-4-12(5-7-14)15-9-18-16-10-19-21(17(16)20-15)11-13-3-2-8-24-13;1-25(22,23)14-6-4-12(5-7-14)16-18-9-15-17(20-16)21(11-19-15)10-13-3-2-8-24-13;;;;;;;/h2-14H,1H3;2-10H,11-12H2,1H3;2-9,12H,10-11,13H2,1H3;2-10,12H,11H2,1H3;2*2-10H,11H2,1H3;2-9,11H,10H2,1H3;7*1H4
InChIKeyPSZKZQOZKUSFEP-UHFFFAOYSA-N
MW2696.56 g/mol
LogP28.26
Rot. Bonds27

About methane;6-(4-methylsulfonylphenyl)-1-phenylpyrrolo[2,3-b]pyridine;2-[[3-(4-methylsulfonylphenyl)pyrrolo[2,3-b]pyrazin-5-yl]methyl]-1,3-thiazole;6-(4-methylsulfonylphenyl)-1-(thiophen-2-ylmethyl)-2,3-dihydropyrrolo[2,3-b]pyridine;5-(4-methylsulfonylphenyl)-3-(thiophen-2-ylmethyl)imidazo[4,5-b]pyridine;2-(4-methylsulfonylphenyl)-9-(thiophen-2-ylmethyl)purine;6-(4-methylsulfonylphenyl)-1-(thiophen-2-ylmethyl)pyrazolo[3,4-b]pyrazine;6-(4-methylsulfonylphenyl)-1-(thiophen-2-ylmethyl)-3H-pyrrolo[2,3-b]pyridin-2-one

methane;6-(4-methylsulfonylphenyl)-1-phenylpyrrolo[2,3-b]pyridine;2-[[3-(4-methylsulfonylphenyl)pyrrolo[2,3-b]pyrazin-5-yl]methyl]-1,3-thiazole;6-(4-methylsulfonylphenyl)-1-(thiophen-2-ylmethyl)-2,3-dihydropyrrolo[2,3-b]pyridine;5-(4-methylsulfonylphenyl)-3-(thiophen-2-ylmethyl)imidazo[4,5-b]pyridine;2-(4-methylsulfonylphenyl)-9-(thiophen-2-ylmethyl)purine;6-(4-methylsulfonylphenyl)-1-(thiophen-2-ylmethyl)pyrazolo[3,4-b]pyrazine;6-(4-methylsulfonylphenyl)-1-(thiophen-2-ylmethyl)-3H-pyrrolo[2,3-b]pyridin-2-one (PubChem CID 167645055) has the molecular formula C134H135N21O15S13 and a molecular weight of 2696.56 g/mol. Its IUPAC name is methane;6-(4-methylsulfonylphenyl)-1-phenylpyrrolo[2,3-b]pyridine;2-[[3-(4-methylsulfonylphenyl)pyrrolo[2,3-b]pyrazin-5-yl]methyl]-1,3-thiazole;6-(4-methylsulfonylphenyl)-1-(thiophen-2-ylmethyl)-2,3-dihydropyrrolo[2,3-b]pyridine;5-(4-methylsulfonylphenyl)-3-(thiophen-2-ylmethyl)imidazo[4,5-b]pyridine;2-(4-methylsulfonylphenyl)-9-(thiophen-2-ylmethyl)purine;6-(4-methylsulfonylphenyl)-1-(thiophen-2-ylmethyl)pyrazolo[3,4-b]pyrazine;6-(4-methylsulfonylphenyl)-1-(thiophen-2-ylmethyl)-3H-pyrrolo[2,3-b]pyridin-2-one.

Molecular Properties

Compound Namemethane;6-(4-methylsulfonylphenyl)-1-phenylpyrrolo[2,3-b]pyridine;2-[[3-(4-methylsulfonylphenyl)pyrrolo[2,3-b]pyrazin-5-yl]methyl]-1,3-thiazole;6-(4-methylsulfonylphenyl)-1-(thiophen-2-ylmethyl)-2,3-dihydropyrrolo[2,3-b]pyridine;5-(4-methylsulfonylphenyl)-3-(thiophen-2-ylmethyl)imidazo[4,5-b]pyridine;2-(4-methylsulfonylphenyl)-9-(thiophen-2-ylmethyl)purine;6-(4-methylsulfonylphenyl)-1-(thiophen-2-ylmethyl)pyrazolo[3,4-b]pyrazine;6-(4-methylsulfonylphenyl)-1-(thiophen-2-ylmethyl)-3H-pyrrolo[2,3-b]pyridin-2-one
PubChem CID167645055
Molecular FormulaC134H135N21O15S13
Molecular Weight2696.56 g/mol
Exact Mass2693.68
IUPAC Namemethane;6-(4-methylsulfonylphenyl)-1-phenylpyrrolo[2,3-b]pyridine;2-[[3-(4-methylsulfonylphenyl)pyrrolo[2,3-b]pyrazin-5-yl]methyl]-1,3-thiazole;6-(4-methylsulfonylphenyl)-1-(thiophen-2-ylmethyl)-2,3-dihydropyrrolo[2,3-b]pyridine;5-(4-methylsulfonylphenyl)-3-(thiophen-2-ylmethyl)imidazo[4,5-b]pyridine;2-(4-methylsulfonylphenyl)-9-(thiophen-2-ylmethyl)purine;6-(4-methylsulfonylphenyl)-1-(thiophen-2-ylmethyl)pyrazolo[3,4-b]pyrazine;6-(4-methylsulfonylphenyl)-1-(thiophen-2-ylmethyl)-3H-pyrrolo[2,3-b]pyridin-2-one
SMILESC.C.C.C.C.C.C.CS(=O)(=O)c1ccc(-c2ccc3c(n2)N(Cc2cccs2)C(=O)C3)cc1.CS(=O)(=O)c1ccc(-c2ccc3c(n2)N(Cc2cccs2)CC3)cc1.CS(=O)(=O)c1ccc(-c2ccc3ccn(-c4ccccc4)c3n2)cc1.CS(=O)(=O)c1ccc(-c2ccc3ncn(Cc4cccs4)c3n2)cc1.CS(=O)(=O)c1ccc(-c2cnc3ccn(Cc4nccs4)c3n2)cc1.CS(=O)(=O)c1ccc(-c2cnc3cnn(Cc4cccs4)c3n2)cc1.CS(=O)(=O)c1ccc(-c2ncc3ncn(Cc4cccs4)c3n2)cc1
InChIInChI=1S/C20H16N2O2S.C19H16N2O3S2.C19H18N2O2S2.C18H15N3O2S2.3C17H14N4O2S2.7CH4/c1-25(23,24)18-10-7-15(8-11-18)19-12-9-16-13-14-22(20(16)21-19)17-5-3-2-4-6-17;1-26(23,24)16-7-4-13(5-8-16)17-9-6-14-11-18(22)21(19(14)20-17)12-15-3-2-10-25-15;1-25(22,23)17-7-4-14(5-8-17)18-9-6-15-10-11-21(19(15)20-18)13-16-3-2-12-24-16;1-25(22,23)15-6-4-13(5-7-15)16-8-9-17-18(20-16)21(12-19-17)11-14-3-2-10-24-14;1-25(22,23)13-4-2-12(3-5-13)15-10-19-14-6-8-21(17(14)20-15)11-16-18-7-9-24-16;1-25(22,23)14-6-4-12(5-7-14)15-9-18-16-10-19-21(17(16)20-15)11-13-3-2-8-24-13;1-25(22,23)14-6-4-12(5-7-14)16-18-9-15-17(20-16)21(11-19-15)10-13-3-2-8-24-13;;;;;;;/h2-14H,1H3;2-10H,11-12H2,1H3;2-9,12H,10-11,13H2,1H3;2-10,12H,11H2,1H3;2*2-10H,11H2,1H3;2-9,11H,10H2,1H3;7*1H4
InChIKeyPSZKZQOZKUSFEP-UHFFFAOYSA-N
XLogP28.26
TPSA467.64 Ų
H-Bond Donors
H-Bond Acceptors41
Rotatable Bonds27
Heavy Atoms183
Complexity—

Lipinski Rule of Five

3 violations

RuleValue
MW ≤ 5002696.56
LogP ≤ 528.26
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 1041

Analyze methane;6-(4-methylsulfonylphenyl)-1-phenylpyrrolo[2,3-b]pyridine;2-[[3-(4-methylsulfonylphenyl)pyrrolo[2,3-b]pyrazin-5-yl]methyl]-1,3-thiazole;6-(4-methylsulfonylphenyl)-1-(thiophen-2-ylmethyl)-2,3-dihydropyrrolo[2,3-b]pyridine;5-(4-methylsulfonylphenyl)-3-(thiophen-2-ylmethyl)imidazo[4,5-b]pyridine;2-(4-methylsulfonylphenyl)-9-(thiophen-2-ylmethyl)purine;6-(4-methylsulfonylphenyl)-1-(thiophen-2-ylmethyl)pyrazolo[3,4-b]pyrazine;6-(4-methylsulfonylphenyl)-1-(thiophen-2-ylmethyl)-3H-pyrrolo[2,3-b]pyridin-2-one with MolForge

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Related Compounds

1-(6-bromoimidazo[1,2-a]pyridin-3-yl)sulfonyl-6-(1-methylpyrazol-4-yl)pyrazolo[4,5-b]pyridine;N,N-dimethyl-4-[3-[6-(1-methylpyrazol-4-yl)pyrazolo[4,5-b]pyridin-1-yl]sulfonylimidazo[1,2-a]pyridin-6-yl]benzamide;6-(1-methylpyrazol-4-yl)-1-(6-phenylimidazo[1,2-a]pyridin-3-yl)sulfonylpyrazolo[4,5-b]pyridine;6-(1-methylpyrazol-4-yl)-1-(6-pyrimidin-5-ylimidazo[1,2-a]pyridin-3-yl)sulfonylpyrazolo[4,5-b]pyridine;6-(1-methylpyrazol-4-yl)-1-(6-thiophen-3-ylimidazo[1,2-a]pyridin-3-yl)sulfonylpyrazolo[4,5-b]pyridine;3-[[6-[1-(1-propan-2-ylpiperidin-4-yl)pyrazol-4-yl]pyrazolo[4,5-b]pyridin-1-yl]methyl]-6-(trifluoromethyl)imidazo[1,2-b]pyridazine
CID 157994145
6-[Difluoro-[6-(1-methylpyrazol-4-yl)-[1,2,4]triazolo[4,3-b]pyridazin-3-yl]methyl]quinoline;6-[difluoro-(6-pyridin-3-yl-[1,2,4]triazolo[4,3-b]pyridazin-3-yl)methyl]quinoline;6-[difluoro-(6-pyridin-4-yl-[1,2,4]triazolo[4,3-b]pyridazin-3-yl)methyl]quinoline;3-[3-[difluoro(quinolin-6-yl)methyl]-[1,2,4]triazolo[4,3-b]pyridazin-6-yl]quinoline;6-[difluoro-(6-thiophen-2-yl-[1,2,4]triazolo[4,3-b]pyridazin-3-yl)methyl]quinoline;(1,1-dioxo-1,4-thiazinan-4-yl)-[5-[3-(quinolin-6-ylmethyl)-[1,2,4]triazolo[4,3-b]pyridazin-6-yl]thiophen-2-yl]methanone;(4-propan-2-ylpiperazin-1-yl)-[5-[3-(quinolin-6-ylmethyl)-[1,2,4]triazolo[4,3-b]pyridazin-6-yl]thiophen-2-yl]methanone;3-[3-(quinolin-6-ylmethyl)-[1,2,4]triazolo[4,3-b]pyridazin-6-yl]quinoline
CID 158095261
1-(4-fluorophenyl)-N-[(1S)-1-(2-methylsulfonyl-4-pyridinyl)ethyl]pyrazolo[3,4-d]pyridazine-4-carboxamide;1-(4-fluorophenyl)-N-[(2-methylsulfonyl-4-pyridinyl)methyl]pyrazolo[3,4-d]pyridazine-4-carboxamide;1-(4-fluorophenyl)-N-[(1S)-1-(2-methylsulfonyl-4-pyridinyl)propyl]pyrazolo[3,4-d]pyridazine-4-carboxamide;1-(4-fluorophenyl)-N-[(1S)-1-(6-methylsulfonyl-3-pyridinyl)propyl]pyrazolo[3,4-d]pyridazine-4-carboxamide;1-(4-fluorophenyl)-N-[[3-(trifluoromethyl)phenyl]methyl]pyrazolo[3,4-d]pyrimidine-4-carboxamide
CID 159322771
1-(6-bromoimidazo[1,2-a]pyridin-3-yl)sulfonyl-6-(1-methylpyrazol-4-yl)pyrazolo[4,5-b]pyridine;N,N-dimethyl-4-[3-[6-(1-methylpyrazol-4-yl)pyrazolo[4,5-b]pyridin-1-yl]sulfonylimidazo[1,2-a]pyridin-6-yl]benzamide;6-(1-methylpyrazol-4-yl)-1-(6-phenylimidazo[1,2-a]pyridin-3-yl)sulfonylpyrazolo[4,5-b]pyridine;6-(1-methylpyrazol-4-yl)-1-(6-thiophen-3-ylimidazo[1,2-a]pyridin-3-yl)sulfonylpyrazolo[4,5-b]pyridine;6-[1-(1-propan-2-ylpiperidin-4-yl)pyrazol-4-yl]-1-[[6-(trifluoromethyl)imidazo[1,2-a]pyridin-3-yl]methyl]pyrazolo[4,5-b]pyridine
CID 159344180
1-[4-[4-(Difluoromethyl)-5-methyl-1,3-thiazol-2-yl]-1-methylpyrazol-5-yl]-2-(2-phenylimidazo[1,2-a]pyridin-7-yl)ethanone;1-[4-[4-(difluoromethyl)-1,3-thiazol-2-yl]-1-methylpyrazol-5-yl]-2-(2-phenylimidazo[1,2-a]pyridin-7-yl)ethanone;1-[1-methyl-4-(5-methyl-2-pyridinyl)pyrazol-5-yl]-2-(2-phenylimidazo[1,2-a]pyridin-7-yl)ethanone;1-[1-methyl-4-(4-methyl-1,3-thiazol-2-yl)pyrazol-5-yl]-2-(2-phenylimidazo[1,2-a]pyridin-7-yl)ethanone;1-[1-methyl-4-[4-(trifluoromethyl)-1,3-thiazol-2-yl]pyrazol-5-yl]-2-(2-phenylimidazo[1,2-a]pyridin-7-yl)ethanone
CID 160257406
2-(6-Fluoro-2-phenyl-[1,2,4]triazolo[1,5-a]pyridin-7-yl)-1-[4-(4-fluoro-2-pyridinyl)-1-methylpyrazol-5-yl]ethanone;2-(6-fluoro-2-phenyl-[1,2,4]triazolo[1,5-a]pyridin-7-yl)-1-[1-methyl-4-(5-methylpyrazin-2-yl)pyrazol-5-yl]ethanone;2-(6-fluoro-2-phenyl-[1,2,4]triazolo[1,5-a]pyridin-7-yl)-1-[1-methyl-4-(4-methyl-2-pyridinyl)pyrazol-5-yl]ethanone;2-(6-fluoro-2-phenyl-[1,2,4]triazolo[1,5-a]pyridin-7-yl)-1-[1-methyl-4-(6-methyl-2-pyridinyl)pyrazol-5-yl]ethanone;2-(6-fluoro-2-phenyl-[1,2,4]triazolo[1,5-a]pyridin-7-yl)-1-[1-methyl-4-[4-(trifluoromethyl)-1,3-thiazol-2-yl]pyrazol-5-yl]ethanone
CID 160592725
2-(2,1,3-Benzothiadiazol-4-yl)-1-[4-(propan-2-ylsulfonylmethyl)piperidin-1-yl]ethanone;2-(1,3-benzothiazol-5-yl)-1-[4-(propan-2-ylsulfonylmethyl)piperidin-1-yl]ethanone;2-[5-(4-fluorophenyl)-1,3,4-thiadiazol-2-yl]-1-[4-(propan-2-ylsulfonylmethyl)piperidin-1-yl]ethanone;2-(4-phenylphenyl)-1-[4-(propan-2-ylsulfonylmethyl)piperidin-1-yl]ethanone;1-[4-(propan-2-ylsulfonylmethyl)piperidin-1-yl]-2-pyrimidin-2-ylethanone;1-[4-(propan-2-ylsulfonylmethyl)piperidin-1-yl]-2-(1,3,5-triazin-2-yl)ethanone;1-[4-(propan-2-ylsulfonylmethyl)piperidin-1-yl]-2-[4-(trifluoromethyl)phenyl]ethanone
CID 161740816
5-[5-[(3,3-difluoropyrrolidin-1-yl)methyl]-3-pyridinyl]-3-[7-[3-fluoro-5-(2-methylsulfonylethyl)phenyl]-3H-imidazo[4,5-c]pyridin-2-yl]-2H-pyrazolo[3,4-b]pyridine;2,2-dimethyl-N-[5-[3-(7-thiophen-2-yl-3H-imidazo[4,5-c]pyridin-2-yl)-2H-pyrazolo[3,4-b]pyridin-5-yl]-3-pyridinyl]propanamide;N-[5-[3-[7-[3-fluoro-5-(2-methylsulfonylethyl)phenyl]-3H-imidazo[4,5-c]pyridin-2-yl]-2H-pyrazolo[3,4-b]pyridin-5-yl]-3-pyridinyl]cyclohexanecarboxamide;3-methyl-N-[5-[3-(7-thiophen-2-yl-3H-imidazo[4,5-c]pyridin-2-yl)-2H-pyrazolo[3,4-b]pyridin-5-yl]-3-pyridinyl]butanamide;N-[5-[3-(7-thiophen-2-yl-3H-imidazo[4,5-c]pyridin-2-yl)-2H-pyrazolo[3,4-b]pyridin-5-yl]-3-pyridinyl]propanamide
CID 161951450
2-(4-cyclopropylphenyl)-1-[4-[6-(1,1-difluoroethyl)pyridazin-3-yl]piperazin-1-yl]ethanone;bis(2-(4-cyclopropylphenyl)-1-[4-([1,3]thiazolo[4,5-b]pyridin-2-yl)piperazin-1-yl]ethanone);N-[4-[2-[4-[6-(1,1-difluoroethyl)pyridazin-3-yl]piperazin-1-yl]-2-oxoethyl]phenyl]methanesulfonamide;bis(2-[4-(dimethylamino)phenyl]-1-[4-([1,3]thiazolo[4,5-b]pyridin-2-yl)piperazin-1-yl]ethanone);N-[4-[2-[4-(6-ethynylpyridazin-3-yl)piperazin-1-yl]-2-oxoethyl]phenyl]ethanesulfonamide;bis(N-[4-[2-oxo-2-[4-([1,3]thiazolo[4,5-b]pyridin-2-yl)piperazin-1-yl]ethyl]phenyl]methanesulfonamide)
CID 165051554
N-[5-[3-[7-(2,3-dihydrothiophen-2-yl)-3H-imidazo[4,5-c]pyridin-2-yl]-7-[2-[2-[5-[5-[(dimethylamino)methyl]-3-pyridinyl]-1H-pyrazolo[5,4-b]pyridin-3-yl]-3H-imidazo[4,5-c]pyridin-7-yl]thiophen-3-yl]-1H-pyrazolo[5,4-b]pyridin-7-ium-5-yl]-3-pyridinyl]-2-phenylacetamide
CID 145664921
8-amino-N-butyl-N-methyl-2-(1,3-thiazol-2-yl)-[1,2,4]triazolo[1,5-a]pyridine-6-carboxamide;8-amino-N-methyl-2-(5-methylthiophen-2-yl)-N-(2-phenylethyl)-[1,2,4]triazolo[1,5-a]pyridine-6-carboxamide;8-amino-N-methyl-2-(5-methylthiophen-2-yl)-N-propyl-[1,2,4]triazolo[1,5-a]pyridine-6-carboxamide;[8-amino-2-(5-methylthiophen-2-yl)-[1,2,4]triazolo[1,5-a]pyridin-6-yl]-(3-methylpiperidin-1-yl)methanone;[8-amino-2-(5-methylthiophen-2-yl)-[1,2,4]triazolo[1,5-a]pyridin-6-yl]-thiomorpholin-4-ylmethanone;[8-amino-2-(1,3-thiazol-2-yl)-[1,2,4]triazolo[1,5-a]pyridin-6-yl]-(3-methylpiperidin-1-yl)methanone;[8-amino-2-(1,3-thiazol-2-yl)-[1,2,4]triazolo[1,5-a]pyridin-6-yl]-(2-methylpyrrolidin-1-yl)methanone;[8-amino-2-(1,3-thiazol-2-yl)-[1,2,4]triazolo[1,5-a]pyridin-6-yl]-pyrrolidin-1-ylmethanone
CID 157097527
1-[4-(4-Tert-butyl-1,3-thiazol-2-yl)-1-methylpyrazol-5-yl]-2-(2-phenyl-5,6,7,8-tetrahydroimidazo[1,2-a]pyridin-7-yl)ethanone;2-[2-(3-fluorophenyl)-5,6,7,8-tetrahydroimidazo[1,2-a]pyridin-7-yl]-1-[1-methyl-4-(6-methylpyrazin-2-yl)pyrazol-5-yl]ethanone;2-[2-(3-fluorophenyl)-5,6,7,8-tetrahydroimidazo[1,2-a]pyridin-7-yl]-1-[1-methyl-4-(4-methylpyrimidin-2-yl)pyrazol-5-yl]ethanone;1-[1-methyl-4-(4-methyl-2-pyridinyl)pyrazol-5-yl]-2-(2-phenyl-5,6,7,8-tetrahydroimidazo[1,2-a]pyridin-7-yl)ethanone;1-[1-methyl-4-(1,3-thiazol-2-yl)pyrazol-5-yl]-2-(2-phenyl-5,6,7,8-tetrahydroimidazo[1,2-a]pyridin-7-yl)ethanone;1-[1-methyl-4-(1,3-thiazol-4-yl)pyrazol-5-yl]-2-(2-phenyl-5,6,7,8-tetrahydroimidazo[1,2-a]pyridin-7-yl)ethanone
CID 157129907

Frequently Asked Questions

What is the IUPAC name of methane;6-(4-methylsulfonylphenyl)-1-phenylpyrrolo[2,3-b]pyridine;2-[[3-(4-methylsulfonylphenyl)pyrrolo[2,3-b]pyrazin-5-yl]methyl]-1,3-thiazole;6-(4-methylsulfonylphenyl)-1-(thiophen-2-ylmethyl)-2,3-dihydropyrrolo[2,3-b]pyridine;5-(4-methylsulfonylphenyl)-3-(thiophen-2-ylmethyl)imidazo[4,5-b]pyridine;2-(4-methylsulfonylphenyl)-9-(thiophen-2-ylmethyl)purine;6-(4-methylsulfonylphenyl)-1-(thiophen-2-ylmethyl)pyrazolo[3,4-b]pyrazine;6-(4-methylsulfonylphenyl)-1-(thiophen-2-ylmethyl)-3H-pyrrolo[2,3-b]pyridin-2-one?
The IUPAC name of methane;6-(4-methylsulfonylphenyl)-1-phenylpyrrolo[2,3-b]pyridine;2-[[3-(4-methylsulfonylphenyl)pyrrolo[2,3-b]pyrazin-5-yl]methyl]-1,3-thiazole;6-(4-methylsulfonylphenyl)-1-(thiophen-2-ylmethyl)-2,3-dihydropyrrolo[2,3-b]pyridine;5-(4-methylsulfonylphenyl)-3-(thiophen-2-ylmethyl)imidazo[4,5-b]pyridine;2-(4-methylsulfonylphenyl)-9-(thiophen-2-ylmethyl)purine;6-(4-methylsulfonylphenyl)-1-(thiophen-2-ylmethyl)pyrazolo[3,4-b]pyrazine;6-(4-methylsulfonylphenyl)-1-(thiophen-2-ylmethyl)-3H-pyrrolo[2,3-b]pyridin-2-one (CID 167645055) is methane;6-(4-methylsulfonylphenyl)-1-phenylpyrrolo[2,3-b]pyridine;2-[[3-(4-methylsulfonylphenyl)pyrrolo[2,3-b]pyrazin-5-yl]methyl]-1,3-thiazole;6-(4-methylsulfonylphenyl)-1-(thiophen-2-ylmethyl)-2,3-dihydropyrrolo[2,3-b]pyridine;5-(4-methylsulfonylphenyl)-3-(thiophen-2-ylmethyl)imidazo[4,5-b]pyridine;2-(4-methylsulfonylphenyl)-9-(thiophen-2-ylmethyl)purine;6-(4-methylsulfonylphenyl)-1-(thiophen-2-ylmethyl)pyrazolo[3,4-b]pyrazine;6-(4-methylsulfonylphenyl)-1-(thiophen-2-ylmethyl)-3H-pyrrolo[2,3-b]pyridin-2-one.
What is the SMILES notation for methane;6-(4-methylsulfonylphenyl)-1-phenylpyrrolo[2,3-b]pyridine;2-[[3-(4-methylsulfonylphenyl)pyrrolo[2,3-b]pyrazin-5-yl]methyl]-1,3-thiazole;6-(4-methylsulfonylphenyl)-1-(thiophen-2-ylmethyl)-2,3-dihydropyrrolo[2,3-b]pyridine;5-(4-methylsulfonylphenyl)-3-(thiophen-2-ylmethyl)imidazo[4,5-b]pyridine;2-(4-methylsulfonylphenyl)-9-(thiophen-2-ylmethyl)purine;6-(4-methylsulfonylphenyl)-1-(thiophen-2-ylmethyl)pyrazolo[3,4-b]pyrazine;6-(4-methylsulfonylphenyl)-1-(thiophen-2-ylmethyl)-3H-pyrrolo[2,3-b]pyridin-2-one?
The canonical SMILES for methane;6-(4-methylsulfonylphenyl)-1-phenylpyrrolo[2,3-b]pyridine;2-[[3-(4-methylsulfonylphenyl)pyrrolo[2,3-b]pyrazin-5-yl]methyl]-1,3-thiazole;6-(4-methylsulfonylphenyl)-1-(thiophen-2-ylmethyl)-2,3-dihydropyrrolo[2,3-b]pyridine;5-(4-methylsulfonylphenyl)-3-(thiophen-2-ylmethyl)imidazo[4,5-b]pyridine;2-(4-methylsulfonylphenyl)-9-(thiophen-2-ylmethyl)purine;6-(4-methylsulfonylphenyl)-1-(thiophen-2-ylmethyl)pyrazolo[3,4-b]pyrazine;6-(4-methylsulfonylphenyl)-1-(thiophen-2-ylmethyl)-3H-pyrrolo[2,3-b]pyridin-2-one is C.C.C.C.C.C.C.CS(=O)(=O)c1ccc(-c2ccc3c(n2)N(Cc2cccs2)C(=O)C3)cc1.CS(=O)(=O)c1ccc(-c2ccc3c(n2)N(Cc2cccs2)CC3)cc1.CS(=O)(=O)c1ccc(-c2ccc3ccn(-c4ccccc4)c3n2)cc1.CS(=O)(=O)c1ccc(-c2ccc3ncn(Cc4cccs4)c3n2)cc1.CS(=O)(=O)c1ccc(-c2cnc3ccn(Cc4nccs4)c3n2)cc1.CS(=O)(=O)c1ccc(-c2cnc3cnn(Cc4cccs4)c3n2)cc1.CS(=O)(=O)c1ccc(-c2ncc3ncn(Cc4cccs4)c3n2)cc1.
What is the InChIKey of methane;6-(4-methylsulfonylphenyl)-1-phenylpyrrolo[2,3-b]pyridine;2-[[3-(4-methylsulfonylphenyl)pyrrolo[2,3-b]pyrazin-5-yl]methyl]-1,3-thiazole;6-(4-methylsulfonylphenyl)-1-(thiophen-2-ylmethyl)-2,3-dihydropyrrolo[2,3-b]pyridine;5-(4-methylsulfonylphenyl)-3-(thiophen-2-ylmethyl)imidazo[4,5-b]pyridine;2-(4-methylsulfonylphenyl)-9-(thiophen-2-ylmethyl)purine;6-(4-methylsulfonylphenyl)-1-(thiophen-2-ylmethyl)pyrazolo[3,4-b]pyrazine;6-(4-methylsulfonylphenyl)-1-(thiophen-2-ylmethyl)-3H-pyrrolo[2,3-b]pyridin-2-one?
The InChIKey is PSZKZQOZKUSFEP-UHFFFAOYSA-N. The full InChI is InChI=1S/C20H16N2O2S.C19H16N2O3S2.C19H18N2O2S2.C18H15N3O2S2.3C17H14N4O2S2.7CH4/c1-25(23,24)18-10-7-15(8-11-18)19-12-9-16-13-14-22(20(16)21-19)17-5-3-2-4-6-17;1-26(23,24)16-7-4-13(5-8-16)17-9-6-14-11-18(22)21(19(14)20-17)12-15-3-2-10-25-15;1-25(22,23)17-7-4-14(5-8-17)18-9-6-15-10-11-21(19(15)20-18)13-16-3-2-12-24-16;1-25(22,23)15-6-4-13(5-7-15)16-8-9-17-18(20-16)21(12-19-17)11-14-3-2-10-24-14;1-25(22,23)13-4-2-12(3-5-13)15-10-19-14-6-8-21(17(14)20-15)11-16-18-7-9-24-16;1-25(22,23)14-6-4-12(5-7-14)15-9-18-16-10-19-21(17(16)20-15)11-13-3-2-8-24-13;1-25(22,23)14-6-4-12(5-7-14)16-18-9-15-17(20-16)21(11-19-15)10-13-3-2-8-24-13;;;;;;;/h2-14H,1H3;2-10H,11-12H2,1H3;2-9,12H,10-11,13H2,1H3;2-10,12H,11H2,1H3;2*2-10H,11H2,1H3;2-9,11H,10H2,1H3;7*1H4.
What are the key properties of methane;6-(4-methylsulfonylphenyl)-1-phenylpyrrolo[2,3-b]pyridine;2-[[3-(4-methylsulfonylphenyl)pyrrolo[2,3-b]pyrazin-5-yl]methyl]-1,3-thiazole;6-(4-methylsulfonylphenyl)-1-(thiophen-2-ylmethyl)-2,3-dihydropyrrolo[2,3-b]pyridine;5-(4-methylsulfonylphenyl)-3-(thiophen-2-ylmethyl)imidazo[4,5-b]pyridine;2-(4-methylsulfonylphenyl)-9-(thiophen-2-ylmethyl)purine;6-(4-methylsulfonylphenyl)-1-(thiophen-2-ylmethyl)pyrazolo[3,4-b]pyrazine;6-(4-methylsulfonylphenyl)-1-(thiophen-2-ylmethyl)-3H-pyrrolo[2,3-b]pyridin-2-one?
methane;6-(4-methylsulfonylphenyl)-1-phenylpyrrolo[2,3-b]pyridine;2-[[3-(4-methylsulfonylphenyl)pyrrolo[2,3-b]pyrazin-5-yl]methyl]-1,3-thiazole;6-(4-methylsulfonylphenyl)-1-(thiophen-2-ylmethyl)-2,3-dihydropyrrolo[2,3-b]pyridine;5-(4-methylsulfonylphenyl)-3-(thiophen-2-ylmethyl)imidazo[4,5-b]pyridine;2-(4-methylsulfonylphenyl)-9-(thiophen-2-ylmethyl)purine;6-(4-methylsulfonylphenyl)-1-(thiophen-2-ylmethyl)pyrazolo[3,4-b]pyrazine;6-(4-methylsulfonylphenyl)-1-(thiophen-2-ylmethyl)-3H-pyrrolo[2,3-b]pyridin-2-one has a molecular weight of 2696.56 g/mol, XLogP of 28.26, 27 rotatable bonds, 0 hydrogen bond donors, and 41 hydrogen bond acceptors.
Where does this data come from?
All data for methane;6-(4-methylsulfonylphenyl)-1-phenylpyrrolo[2,3-b]pyridine;2-[[3-(4-methylsulfonylphenyl)pyrrolo[2,3-b]pyrazin-5-yl]methyl]-1,3-thiazole;6-(4-methylsulfonylphenyl)-1-(thiophen-2-ylmethyl)-2,3-dihydropyrrolo[2,3-b]pyridine;5-(4-methylsulfonylphenyl)-3-(thiophen-2-ylmethyl)imidazo[4,5-b]pyridine;2-(4-methylsulfonylphenyl)-9-(thiophen-2-ylmethyl)purine;6-(4-methylsulfonylphenyl)-1-(thiophen-2-ylmethyl)pyrazolo[3,4-b]pyrazine;6-(4-methylsulfonylphenyl)-1-(thiophen-2-ylmethyl)-3H-pyrrolo[2,3-b]pyridin-2-one is sourced from PubChem (CID 167645055), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).