About 2-[[7-[5-chloro-2-[(1R,2S)-2-fluorocyclopentyl]oxy-3-methylphenyl]thieno[3,2-b]pyridin-2-yl]methyl]-6,7,8,8a-tetrahydro-5H-imidazo[1,5-a]pyridine-1,3-dione;3-[[7-[5-chloro-2-[(1R,2S)-2-fluorocyclopentyl]oxy-3-methylphenyl]thieno[3,2-b]pyridin-2-yl]methyl]-5,5-dimethyl-1,3-oxazolidine-2,4-dione;1-[(1S)-1-[7-[5-chloro-2-[(1R,2S)-2-fluorocyclopentyl]oxy-3-methylphenyl]thieno[3,2-b]pyridin-2-yl]propyl]pyrrolidine-2,5-dione;1-[[4-[5-chloro-2-[(1R,2S)-2-fluorocyclopentyl]oxy-3-methylphenyl]thieno[3,2-d]pyrimidin-6-yl]methyl]piperidine-2,6-dione;5-[2-[(2,5-dioxopyrrolidin-1-yl)methyl]thieno[3,2-b]pyridin-7-yl]-2-fluoro-4-[(1R,2S)-2-fluorocyclopentyl]oxybenzonitrile;3-[[7-[2-[(1R,2S)-2-fluorocyclopentyl]oxy-3-methyl-5-(trifluoromethyl)phenyl]thieno[3,2-b]pyridin-2-yl]methyl]-1-methylpyrimidine-2,4-dione;5-fluoro-3-[[7-[2-[(1R,2S)-2-fluorocyclopentyl]oxy-3-methyl-5-(trifluoromethyl)phenyl]thieno[3,2-b]pyridin-2-yl]methyl]-1H-pyrimidine-2,4-dione
2-[[7-[5-chloro-2-[(1R,2S)-2-fluorocyclopentyl]oxy-3-methylphenyl]thieno[3,2-b]pyridin-2-yl]methyl]-6,7,8,8a-tetrahydro-5H-imidazo[1,5-a]pyridine-1,3-dione;3-[[7-[5-chloro-2-[(1R,2S)-2-fluorocyclopentyl]oxy-3-methylphenyl]thieno[3,2-b]pyridin-2-yl]methyl]-5,5-dimethyl-1,3-oxazolidine-2,4-dione;1-[(1S)-1-[7-[5-chloro-2-[(1R,2S)-2-fluorocyclopentyl]oxy-3-methylphenyl]thieno[3,2-b]pyridin-2-yl]propyl]pyrrolidine-2,5-dione;1-[[4-[5-chloro-2-[(1R,2S)-2-fluorocyclopentyl]oxy-3-methylphenyl]thieno[3,2-d]pyrimidin-6-yl]methyl]piperidine-2,6-dione;5-[2-[(2,5-dioxopyrrolidin-1-yl)methyl]thieno[3,2-b]pyridin-7-yl]-2-fluoro-4-[(1R,2S)-2-fluorocyclopentyl]oxybenzonitrile;3-[[7-[2-[(1R,2S)-2-fluorocyclopentyl]oxy-3-methyl-5-(trifluoromethyl)phenyl]thieno[3,2-b]pyridin-2-yl]methyl]-1-methylpyrimidine-2,4-dione;5-fluoro-3-[[7-[2-[(1R,2S)-2-fluorocyclopentyl]oxy-3-methyl-5-(trifluoromethyl)phenyl]thieno[3,2-b]pyridin-2-yl]methyl]-1H-pyrimidine-2,4-dione (PubChem CID 159584652) has the molecular formula C177H162Cl4F15N19O22S7
and a molecular weight of 3558.60 g/mol. Its IUPAC name is 2-[[7-[5-chloro-2-[(1R,2S)-2-fluorocyclopentyl]oxy-3-methylphenyl]thieno[3,2-b]pyridin-2-yl]methyl]-6,7,8,8a-tetrahydro-5H-imidazo[1,5-a]pyridine-1,3-dione;3-[[7-[5-chloro-2-[(1R,2S)-2-fluorocyclopentyl]oxy-3-methylphenyl]thieno[3,2-b]pyridin-2-yl]methyl]-5,5-dimethyl-1,3-oxazolidine-2,4-dione;1-[(1S)-1-[7-[5-chloro-2-[(1R,2S)-2-fluorocyclopentyl]oxy-3-methylphenyl]thieno[3,2-b]pyridin-2-yl]propyl]pyrrolidine-2,5-dione;1-[[4-[5-chloro-2-[(1R,2S)-2-fluorocyclopentyl]oxy-3-methylphenyl]thieno[3,2-d]pyrimidin-6-yl]methyl]piperidine-2,6-dione;5-[2-[(2,5-dioxopyrrolidin-1-yl)methyl]thieno[3,2-b]pyridin-7-yl]-2-fluoro-4-[(1R,2S)-2-fluorocyclopentyl]oxybenzonitrile;3-[[7-[2-[(1R,2S)-2-fluorocyclopentyl]oxy-3-methyl-5-(trifluoromethyl)phenyl]thieno[3,2-b]pyridin-2-yl]methyl]-1-methylpyrimidine-2,4-dione;5-fluoro-3-[[7-[2-[(1R,2S)-2-fluorocyclopentyl]oxy-3-methyl-5-(trifluoromethyl)phenyl]thieno[3,2-b]pyridin-2-yl]methyl]-1H-pyrimidine-2,4-dione.
Frequently Asked Questions
What is the IUPAC name of 2-[[7-[5-chloro-2-[(1R,2S)-2-fluorocyclopentyl]oxy-3-methylphenyl]thieno[3,2-b]pyridin-2-yl]methyl]-6,7,8,8a-tetrahydro-5H-imidazo[1,5-a]pyridine-1,3-dione;3-[[7-[5-chloro-2-[(1R,2S)-2-fluorocyclopentyl]oxy-3-methylphenyl]thieno[3,2-b]pyridin-2-yl]methyl]-5,5-dimethyl-1,3-oxazolidine-2,4-dione;1-[(1S)-1-[7-[5-chloro-2-[(1R,2S)-2-fluorocyclopentyl]oxy-3-methylphenyl]thieno[3,2-b]pyridin-2-yl]propyl]pyrrolidine-2,5-dione;1-[[4-[5-chloro-2-[(1R,2S)-2-fluorocyclopentyl]oxy-3-methylphenyl]thieno[3,2-d]pyrimidin-6-yl]methyl]piperidine-2,6-dione;5-[2-[(2,5-dioxopyrrolidin-1-yl)methyl]thieno[3,2-b]pyridin-7-yl]-2-fluoro-4-[(1R,2S)-2-fluorocyclopentyl]oxybenzonitrile;3-[[7-[2-[(1R,2S)-2-fluorocyclopentyl]oxy-3-methyl-5-(trifluoromethyl)phenyl]thieno[3,2-b]pyridin-2-yl]methyl]-1-methylpyrimidine-2,4-dione;5-fluoro-3-[[7-[2-[(1R,2S)-2-fluorocyclopentyl]oxy-3-methyl-5-(trifluoromethyl)phenyl]thieno[3,2-b]pyridin-2-yl]methyl]-1H-pyrimidine-2,4-dione?
The IUPAC name of 2-[[7-[5-chloro-2-[(1R,2S)-2-fluorocyclopentyl]oxy-3-methylphenyl]thieno[3,2-b]pyridin-2-yl]methyl]-6,7,8,8a-tetrahydro-5H-imidazo[1,5-a]pyridine-1,3-dione;3-[[7-[5-chloro-2-[(1R,2S)-2-fluorocyclopentyl]oxy-3-methylphenyl]thieno[3,2-b]pyridin-2-yl]methyl]-5,5-dimethyl-1,3-oxazolidine-2,4-dione;1-[(1S)-1-[7-[5-chloro-2-[(1R,2S)-2-fluorocyclopentyl]oxy-3-methylphenyl]thieno[3,2-b]pyridin-2-yl]propyl]pyrrolidine-2,5-dione;1-[[4-[5-chloro-2-[(1R,2S)-2-fluorocyclopentyl]oxy-3-methylphenyl]thieno[3,2-d]pyrimidin-6-yl]methyl]piperidine-2,6-dione;5-[2-[(2,5-dioxopyrrolidin-1-yl)methyl]thieno[3,2-b]pyridin-7-yl]-2-fluoro-4-[(1R,2S)-2-fluorocyclopentyl]oxybenzonitrile;3-[[7-[2-[(1R,2S)-2-fluorocyclopentyl]oxy-3-methyl-5-(trifluoromethyl)phenyl]thieno[3,2-b]pyridin-2-yl]methyl]-1-methylpyrimidine-2,4-dione;5-fluoro-3-[[7-[2-[(1R,2S)-2-fluorocyclopentyl]oxy-3-methyl-5-(trifluoromethyl)phenyl]thieno[3,2-b]pyridin-2-yl]methyl]-1H-pyrimidine-2,4-dione (CID 159584652) is 2-[[7-[5-chloro-2-[(1R,2S)-2-fluorocyclopentyl]oxy-3-methylphenyl]thieno[3,2-b]pyridin-2-yl]methyl]-6,7,8,8a-tetrahydro-5H-imidazo[1,5-a]pyridine-1,3-dione;3-[[7-[5-chloro-2-[(1R,2S)-2-fluorocyclopentyl]oxy-3-methylphenyl]thieno[3,2-b]pyridin-2-yl]methyl]-5,5-dimethyl-1,3-oxazolidine-2,4-dione;1-[(1S)-1-[7-[5-chloro-2-[(1R,2S)-2-fluorocyclopentyl]oxy-3-methylphenyl]thieno[3,2-b]pyridin-2-yl]propyl]pyrrolidine-2,5-dione;1-[[4-[5-chloro-2-[(1R,2S)-2-fluorocyclopentyl]oxy-3-methylphenyl]thieno[3,2-d]pyrimidin-6-yl]methyl]piperidine-2,6-dione;5-[2-[(2,5-dioxopyrrolidin-1-yl)methyl]thieno[3,2-b]pyridin-7-yl]-2-fluoro-4-[(1R,2S)-2-fluorocyclopentyl]oxybenzonitrile;3-[[7-[2-[(1R,2S)-2-fluorocyclopentyl]oxy-3-methyl-5-(trifluoromethyl)phenyl]thieno[3,2-b]pyridin-2-yl]methyl]-1-methylpyrimidine-2,4-dione;5-fluoro-3-[[7-[2-[(1R,2S)-2-fluorocyclopentyl]oxy-3-methyl-5-(trifluoromethyl)phenyl]thieno[3,2-b]pyridin-2-yl]methyl]-1H-pyrimidine-2,4-dione.
What is the SMILES notation for 2-[[7-[5-chloro-2-[(1R,2S)-2-fluorocyclopentyl]oxy-3-methylphenyl]thieno[3,2-b]pyridin-2-yl]methyl]-6,7,8,8a-tetrahydro-5H-imidazo[1,5-a]pyridine-1,3-dione;3-[[7-[5-chloro-2-[(1R,2S)-2-fluorocyclopentyl]oxy-3-methylphenyl]thieno[3,2-b]pyridin-2-yl]methyl]-5,5-dimethyl-1,3-oxazolidine-2,4-dione;1-[(1S)-1-[7-[5-chloro-2-[(1R,2S)-2-fluorocyclopentyl]oxy-3-methylphenyl]thieno[3,2-b]pyridin-2-yl]propyl]pyrrolidine-2,5-dione;1-[[4-[5-chloro-2-[(1R,2S)-2-fluorocyclopentyl]oxy-3-methylphenyl]thieno[3,2-d]pyrimidin-6-yl]methyl]piperidine-2,6-dione;5-[2-[(2,5-dioxopyrrolidin-1-yl)methyl]thieno[3,2-b]pyridin-7-yl]-2-fluoro-4-[(1R,2S)-2-fluorocyclopentyl]oxybenzonitrile;3-[[7-[2-[(1R,2S)-2-fluorocyclopentyl]oxy-3-methyl-5-(trifluoromethyl)phenyl]thieno[3,2-b]pyridin-2-yl]methyl]-1-methylpyrimidine-2,4-dione;5-fluoro-3-[[7-[2-[(1R,2S)-2-fluorocyclopentyl]oxy-3-methyl-5-(trifluoromethyl)phenyl]thieno[3,2-b]pyridin-2-yl]methyl]-1H-pyrimidine-2,4-dione?
The canonical SMILES for 2-[[7-[5-chloro-2-[(1R,2S)-2-fluorocyclopentyl]oxy-3-methylphenyl]thieno[3,2-b]pyridin-2-yl]methyl]-6,7,8,8a-tetrahydro-5H-imidazo[1,5-a]pyridine-1,3-dione;3-[[7-[5-chloro-2-[(1R,2S)-2-fluorocyclopentyl]oxy-3-methylphenyl]thieno[3,2-b]pyridin-2-yl]methyl]-5,5-dimethyl-1,3-oxazolidine-2,4-dione;1-[(1S)-1-[7-[5-chloro-2-[(1R,2S)-2-fluorocyclopentyl]oxy-3-methylphenyl]thieno[3,2-b]pyridin-2-yl]propyl]pyrrolidine-2,5-dione;1-[[4-[5-chloro-2-[(1R,2S)-2-fluorocyclopentyl]oxy-3-methylphenyl]thieno[3,2-d]pyrimidin-6-yl]methyl]piperidine-2,6-dione;5-[2-[(2,5-dioxopyrrolidin-1-yl)methyl]thieno[3,2-b]pyridin-7-yl]-2-fluoro-4-[(1R,2S)-2-fluorocyclopentyl]oxybenzonitrile;3-[[7-[2-[(1R,2S)-2-fluorocyclopentyl]oxy-3-methyl-5-(trifluoromethyl)phenyl]thieno[3,2-b]pyridin-2-yl]methyl]-1-methylpyrimidine-2,4-dione;5-fluoro-3-[[7-[2-[(1R,2S)-2-fluorocyclopentyl]oxy-3-methyl-5-(trifluoromethyl)phenyl]thieno[3,2-b]pyridin-2-yl]methyl]-1H-pyrimidine-2,4-dione is CC[C@@H](c1cc2nccc(-c3cc(Cl)cc(C)c3O[C@@H]3CCC[C@@H]3F)c2s1)N1C(=O)CCC1=O.Cc1cc(C(F)(F)F)cc(-c2ccnc3cc(Cn4c(=O)[nH]cc(F)c4=O)sc23)c1O[C@@H]1CCC[C@@H]1F.Cc1cc(C(F)(F)F)cc(-c2ccnc3cc(Cn4c(=O)ccn(C)c4=O)sc23)c1O[C@@H]1CCC[C@@H]1F.Cc1cc(Cl)cc(-c2ccnc3cc(CN4C(=O)C5CCCCN5C4=O)sc23)c1O[C@@H]1CCC[C@@H]1F.Cc1cc(Cl)cc(-c2ccnc3cc(CN4C(=O)OC(C)(C)C4=O)sc23)c1O[C@@H]1CCC[C@@H]1F.Cc1cc(Cl)cc(-c2ncnc3cc(CN4C(=O)CCCC4=O)sc23)c1O[C@@H]1CCC[C@@H]1F.N#Cc1cc(-c2ccnc3cc(CN4C(=O)CCC4=O)sc23)c(O[C@@H]2CCC[C@@H]2F)cc1F.
What is the InChIKey of 2-[[7-[5-chloro-2-[(1R,2S)-2-fluorocyclopentyl]oxy-3-methylphenyl]thieno[3,2-b]pyridin-2-yl]methyl]-6,7,8,8a-tetrahydro-5H-imidazo[1,5-a]pyridine-1,3-dione;3-[[7-[5-chloro-2-[(1R,2S)-2-fluorocyclopentyl]oxy-3-methylphenyl]thieno[3,2-b]pyridin-2-yl]methyl]-5,5-dimethyl-1,3-oxazolidine-2,4-dione;1-[(1S)-1-[7-[5-chloro-2-[(1R,2S)-2-fluorocyclopentyl]oxy-3-methylphenyl]thieno[3,2-b]pyridin-2-yl]propyl]pyrrolidine-2,5-dione;1-[[4-[5-chloro-2-[(1R,2S)-2-fluorocyclopentyl]oxy-3-methylphenyl]thieno[3,2-d]pyrimidin-6-yl]methyl]piperidine-2,6-dione;5-[2-[(2,5-dioxopyrrolidin-1-yl)methyl]thieno[3,2-b]pyridin-7-yl]-2-fluoro-4-[(1R,2S)-2-fluorocyclopentyl]oxybenzonitrile;3-[[7-[2-[(1R,2S)-2-fluorocyclopentyl]oxy-3-methyl-5-(trifluoromethyl)phenyl]thieno[3,2-b]pyridin-2-yl]methyl]-1-methylpyrimidine-2,4-dione;5-fluoro-3-[[7-[2-[(1R,2S)-2-fluorocyclopentyl]oxy-3-methyl-5-(trifluoromethyl)phenyl]thieno[3,2-b]pyridin-2-yl]methyl]-1H-pyrimidine-2,4-dione?
The InChIKey is MJLOZDPOHNPHAX-IWYSTRLDSA-N. The full InChI is InChI=1S/C27H27ClFN3O3S.C26H26ClFN2O3S.C26H23F4N3O3S.C25H24ClFN2O4S.C25H20F5N3O3S.C24H23ClFN3O3S.C24H19F2N3O3S/c1-15-11-16(28)12-19(24(15)35-23-7-4-5-20(23)29)18-8-9-30-21-13-17(36-25(18)21)14-32-26(33)22-6-2-3-10-31(22)27(32)34;1-3-20(30-23(31)7-8-24(30)32)22-13-19-26(34-22)16(9-10-29-19)17-12-15(27)11-14(2)25(17)33-21-6-4-5-18(21)28;1-14-10-15(26(28,29)30)11-18(23(14)36-21-5-3-4-19(21)27)17-6-8-31-20-12-16(37-24(17)20)13-33-22(34)7-9-32(2)25(33)35;1-13-9-14(26)10-17(21(13)32-20-6-4-5-18(20)27)16-7-8-28-19-11-15(34-22(16)19)12-29-23(30)25(2,3)33-24(29)31;1-12-7-13(25(28,29)30)8-16(21(12)36-20-4-2-3-17(20)26)15-5-6-31-19-9-14(37-22(15)19)11-33-23(34)18(27)10-32-24(33)35;1-13-8-14(25)9-16(23(13)32-19-5-2-4-17(19)26)22-24-18(27-12-28-22)10-15(33-24)11-29-20(30)6-3-7-21(29)31;25-17-2-1-3-20(17)32-21-10-18(26)13(11-27)8-16(21)15-6-7-28-19-9-14(33-24(15)19)12-29-22(30)4-5-23(29)31/h8-9,11-13,20,22-23H,2-7,10,14H2,1H3;9-13,18,20-21H,3-8H2,1-2H3;6-12,19,21H,3-5,13H2,1-2H3;7-11,18,20H,4-6,12H2,1-3H3;5-10,17,20H,2-4,11H2,1H3,(H,32,35);8-10,12,17,19H,2-7,11H2,1H3;6-10,17,20H,1-5,12H2/t20-,22?,23+;18-,20-,21+;19-,21+;18-,20+;17-,20+;17-,19+;17-,20+/m0000000/s1.
What are the key properties of 2-[[7-[5-chloro-2-[(1R,2S)-2-fluorocyclopentyl]oxy-3-methylphenyl]thieno[3,2-b]pyridin-2-yl]methyl]-6,7,8,8a-tetrahydro-5H-imidazo[1,5-a]pyridine-1,3-dione;3-[[7-[5-chloro-2-[(1R,2S)-2-fluorocyclopentyl]oxy-3-methylphenyl]thieno[3,2-b]pyridin-2-yl]methyl]-5,5-dimethyl-1,3-oxazolidine-2,4-dione;1-[(1S)-1-[7-[5-chloro-2-[(1R,2S)-2-fluorocyclopentyl]oxy-3-methylphenyl]thieno[3,2-b]pyridin-2-yl]propyl]pyrrolidine-2,5-dione;1-[[4-[5-chloro-2-[(1R,2S)-2-fluorocyclopentyl]oxy-3-methylphenyl]thieno[3,2-d]pyrimidin-6-yl]methyl]piperidine-2,6-dione;5-[2-[(2,5-dioxopyrrolidin-1-yl)methyl]thieno[3,2-b]pyridin-7-yl]-2-fluoro-4-[(1R,2S)-2-fluorocyclopentyl]oxybenzonitrile;3-[[7-[2-[(1R,2S)-2-fluorocyclopentyl]oxy-3-methyl-5-(trifluoromethyl)phenyl]thieno[3,2-b]pyridin-2-yl]methyl]-1-methylpyrimidine-2,4-dione;5-fluoro-3-[[7-[2-[(1R,2S)-2-fluorocyclopentyl]oxy-3-methyl-5-(trifluoromethyl)phenyl]thieno[3,2-b]pyridin-2-yl]methyl]-1H-pyrimidine-2,4-dione?
2-[[7-[5-chloro-2-[(1R,2S)-2-fluorocyclopentyl]oxy-3-methylphenyl]thieno[3,2-b]pyridin-2-yl]methyl]-6,7,8,8a-tetrahydro-5H-imidazo[1,5-a]pyridine-1,3-dione;3-[[7-[5-chloro-2-[(1R,2S)-2-fluorocyclopentyl]oxy-3-methylphenyl]thieno[3,2-b]pyridin-2-yl]methyl]-5,5-dimethyl-1,3-oxazolidine-2,4-dione;1-[(1S)-1-[7-[5-chloro-2-[(1R,2S)-2-fluorocyclopentyl]oxy-3-methylphenyl]thieno[3,2-b]pyridin-2-yl]propyl]pyrrolidine-2,5-dione;1-[[4-[5-chloro-2-[(1R,2S)-2-fluorocyclopentyl]oxy-3-methylphenyl]thieno[3,2-d]pyrimidin-6-yl]methyl]piperidine-2,6-dione;5-[2-[(2,5-dioxopyrrolidin-1-yl)methyl]thieno[3,2-b]pyridin-7-yl]-2-fluoro-4-[(1R,2S)-2-fluorocyclopentyl]oxybenzonitrile;3-[[7-[2-[(1R,2S)-2-fluorocyclopentyl]oxy-3-methyl-5-(trifluoromethyl)phenyl]thieno[3,2-b]pyridin-2-yl]methyl]-1-methylpyrimidine-2,4-dione;5-fluoro-3-[[7-[2-[(1R,2S)-2-fluorocyclopentyl]oxy-3-methyl-5-(trifluoromethyl)phenyl]thieno[3,2-b]pyridin-2-yl]methyl]-1H-pyrimidine-2,4-dione has a molecular weight of 3558.60 g/mol, XLogP of 41.34, 36 rotatable bonds, 1 hydrogen bond donors, and 41 hydrogen bond acceptors.
Where does this data come from?
All data for 2-[[7-[5-chloro-2-[(1R,2S)-2-fluorocyclopentyl]oxy-3-methylphenyl]thieno[3,2-b]pyridin-2-yl]methyl]-6,7,8,8a-tetrahydro-5H-imidazo[1,5-a]pyridine-1,3-dione;3-[[7-[5-chloro-2-[(1R,2S)-2-fluorocyclopentyl]oxy-3-methylphenyl]thieno[3,2-b]pyridin-2-yl]methyl]-5,5-dimethyl-1,3-oxazolidine-2,4-dione;1-[(1S)-1-[7-[5-chloro-2-[(1R,2S)-2-fluorocyclopentyl]oxy-3-methylphenyl]thieno[3,2-b]pyridin-2-yl]propyl]pyrrolidine-2,5-dione;1-[[4-[5-chloro-2-[(1R,2S)-2-fluorocyclopentyl]oxy-3-methylphenyl]thieno[3,2-d]pyrimidin-6-yl]methyl]piperidine-2,6-dione;5-[2-[(2,5-dioxopyrrolidin-1-yl)methyl]thieno[3,2-b]pyridin-7-yl]-2-fluoro-4-[(1R,2S)-2-fluorocyclopentyl]oxybenzonitrile;3-[[7-[2-[(1R,2S)-2-fluorocyclopentyl]oxy-3-methyl-5-(trifluoromethyl)phenyl]thieno[3,2-b]pyridin-2-yl]methyl]-1-methylpyrimidine-2,4-dione;5-fluoro-3-[[7-[2-[(1R,2S)-2-fluorocyclopentyl]oxy-3-methyl-5-(trifluoromethyl)phenyl]thieno[3,2-b]pyridin-2-yl]methyl]-1H-pyrimidine-2,4-dione is sourced from PubChem (CID 159584652), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).