About 2-[(5-bromo-2-ethyl-7-methylpyrazolo[4,3-b]pyridin-3-yl)amino]-4-(4-fluorophenyl)-1,3-thiazole-5-carbonitrile;2-[(5-bromo-2-ethyl-7-methylpyrazolo[4,3-b]pyridin-3-yl)-(2,2-difluoroethyl)amino]-4-(4-fluorophenyl)-1,3-thiazole-5-carbonitrile;tert-butyl 4-[3-[[5-cyano-4-(4-fluorophenyl)-1,3-thiazol-2-yl]-(2,2-difluoroethyl)amino]-2-ethyl-7-methylpyrazolo[4,3-b]pyridin-5-yl]piperazine-1-carboxylate;2-chloro-1-(3-hydroxyazetidin-1-yl)ethanone;2-[2,2-difluoroethyl-[2-ethyl-5-[4-[2-(3-hydroxyazetidin-1-yl)-2-oxoethyl]piperazin-1-yl]-7-methylpyrazolo[4,3-b]pyridin-3-yl]amino]-4-(4-fluorophenyl)-1,3-thiazole-5-carbonitrile;2-[2,2-difluoroethyl-(2-ethyl-7-methyl-5-piperazin-1-ylpyrazolo[4,3-b]pyridin-3-yl)amino]-4-(4-fluorophenyl)-1,3-thiazole-5-carbonitrile;iodoethane;piperidine
2-[(5-bromo-2-ethyl-7-methylpyrazolo[4,3-b]pyridin-3-yl)amino]-4-(4-fluorophenyl)-1,3-thiazole-5-carbonitrile;2-[(5-bromo-2-ethyl-7-methylpyrazolo[4,3-b]pyridin-3-yl)-(2,2-difluoroethyl)amino]-4-(4-fluorophenyl)-1,3-thiazole-5-carbonitrile;tert-butyl 4-[3-[[5-cyano-4-(4-fluorophenyl)-1,3-thiazol-2-yl]-(2,2-difluoroethyl)amino]-2-ethyl-7-methylpyrazolo[4,3-b]pyridin-5-yl]piperazine-1-carboxylate;2-chloro-1-(3-hydroxyazetidin-1-yl)ethanone;2-[2,2-difluoroethyl-[2-ethyl-5-[4-[2-(3-hydroxyazetidin-1-yl)-2-oxoethyl]piperazin-1-yl]-7-methylpyrazolo[4,3-b]pyridin-3-yl]amino]-4-(4-fluorophenyl)-1,3-thiazole-5-carbonitrile;2-[2,2-difluoroethyl-(2-ethyl-7-methyl-5-piperazin-1-ylpyrazolo[4,3-b]pyridin-3-yl)amino]-4-(4-fluorophenyl)-1,3-thiazole-5-carbonitrile;iodoethane;piperidine (PubChem CID 158321598) has the molecular formula C137H144Br2ClF13IN39O6S5
and a molecular weight of 3162.40 g/mol. Its IUPAC name is 2-[(5-bromo-2-ethyl-7-methylpyrazolo[4,3-b]pyridin-3-yl)amino]-4-(4-fluorophenyl)-1,3-thiazole-5-carbonitrile;2-[(5-bromo-2-ethyl-7-methylpyrazolo[4,3-b]pyridin-3-yl)-(2,2-difluoroethyl)amino]-4-(4-fluorophenyl)-1,3-thiazole-5-carbonitrile;tert-butyl 4-[3-[[5-cyano-4-(4-fluorophenyl)-1,3-thiazol-2-yl]-(2,2-difluoroethyl)amino]-2-ethyl-7-methylpyrazolo[4,3-b]pyridin-5-yl]piperazine-1-carboxylate;2-chloro-1-(3-hydroxyazetidin-1-yl)ethanone;2-[2,2-difluoroethyl-[2-ethyl-5-[4-[2-(3-hydroxyazetidin-1-yl)-2-oxoethyl]piperazin-1-yl]-7-methylpyrazolo[4,3-b]pyridin-3-yl]amino]-4-(4-fluorophenyl)-1,3-thiazole-5-carbonitrile;2-[2,2-difluoroethyl-(2-ethyl-7-methyl-5-piperazin-1-ylpyrazolo[4,3-b]pyridin-3-yl)amino]-4-(4-fluorophenyl)-1,3-thiazole-5-carbonitrile;iodoethane;piperidine.
Frequently Asked Questions
What is the IUPAC name of 2-[(5-bromo-2-ethyl-7-methylpyrazolo[4,3-b]pyridin-3-yl)amino]-4-(4-fluorophenyl)-1,3-thiazole-5-carbonitrile;2-[(5-bromo-2-ethyl-7-methylpyrazolo[4,3-b]pyridin-3-yl)-(2,2-difluoroethyl)amino]-4-(4-fluorophenyl)-1,3-thiazole-5-carbonitrile;tert-butyl 4-[3-[[5-cyano-4-(4-fluorophenyl)-1,3-thiazol-2-yl]-(2,2-difluoroethyl)amino]-2-ethyl-7-methylpyrazolo[4,3-b]pyridin-5-yl]piperazine-1-carboxylate;2-chloro-1-(3-hydroxyazetidin-1-yl)ethanone;2-[2,2-difluoroethyl-[2-ethyl-5-[4-[2-(3-hydroxyazetidin-1-yl)-2-oxoethyl]piperazin-1-yl]-7-methylpyrazolo[4,3-b]pyridin-3-yl]amino]-4-(4-fluorophenyl)-1,3-thiazole-5-carbonitrile;2-[2,2-difluoroethyl-(2-ethyl-7-methyl-5-piperazin-1-ylpyrazolo[4,3-b]pyridin-3-yl)amino]-4-(4-fluorophenyl)-1,3-thiazole-5-carbonitrile;iodoethane;piperidine?
The IUPAC name of 2-[(5-bromo-2-ethyl-7-methylpyrazolo[4,3-b]pyridin-3-yl)amino]-4-(4-fluorophenyl)-1,3-thiazole-5-carbonitrile;2-[(5-bromo-2-ethyl-7-methylpyrazolo[4,3-b]pyridin-3-yl)-(2,2-difluoroethyl)amino]-4-(4-fluorophenyl)-1,3-thiazole-5-carbonitrile;tert-butyl 4-[3-[[5-cyano-4-(4-fluorophenyl)-1,3-thiazol-2-yl]-(2,2-difluoroethyl)amino]-2-ethyl-7-methylpyrazolo[4,3-b]pyridin-5-yl]piperazine-1-carboxylate;2-chloro-1-(3-hydroxyazetidin-1-yl)ethanone;2-[2,2-difluoroethyl-[2-ethyl-5-[4-[2-(3-hydroxyazetidin-1-yl)-2-oxoethyl]piperazin-1-yl]-7-methylpyrazolo[4,3-b]pyridin-3-yl]amino]-4-(4-fluorophenyl)-1,3-thiazole-5-carbonitrile;2-[2,2-difluoroethyl-(2-ethyl-7-methyl-5-piperazin-1-ylpyrazolo[4,3-b]pyridin-3-yl)amino]-4-(4-fluorophenyl)-1,3-thiazole-5-carbonitrile;iodoethane;piperidine (CID 158321598) is 2-[(5-bromo-2-ethyl-7-methylpyrazolo[4,3-b]pyridin-3-yl)amino]-4-(4-fluorophenyl)-1,3-thiazole-5-carbonitrile;2-[(5-bromo-2-ethyl-7-methylpyrazolo[4,3-b]pyridin-3-yl)-(2,2-difluoroethyl)amino]-4-(4-fluorophenyl)-1,3-thiazole-5-carbonitrile;tert-butyl 4-[3-[[5-cyano-4-(4-fluorophenyl)-1,3-thiazol-2-yl]-(2,2-difluoroethyl)amino]-2-ethyl-7-methylpyrazolo[4,3-b]pyridin-5-yl]piperazine-1-carboxylate;2-chloro-1-(3-hydroxyazetidin-1-yl)ethanone;2-[2,2-difluoroethyl-[2-ethyl-5-[4-[2-(3-hydroxyazetidin-1-yl)-2-oxoethyl]piperazin-1-yl]-7-methylpyrazolo[4,3-b]pyridin-3-yl]amino]-4-(4-fluorophenyl)-1,3-thiazole-5-carbonitrile;2-[2,2-difluoroethyl-(2-ethyl-7-methyl-5-piperazin-1-ylpyrazolo[4,3-b]pyridin-3-yl)amino]-4-(4-fluorophenyl)-1,3-thiazole-5-carbonitrile;iodoethane;piperidine.
What is the SMILES notation for 2-[(5-bromo-2-ethyl-7-methylpyrazolo[4,3-b]pyridin-3-yl)amino]-4-(4-fluorophenyl)-1,3-thiazole-5-carbonitrile;2-[(5-bromo-2-ethyl-7-methylpyrazolo[4,3-b]pyridin-3-yl)-(2,2-difluoroethyl)amino]-4-(4-fluorophenyl)-1,3-thiazole-5-carbonitrile;tert-butyl 4-[3-[[5-cyano-4-(4-fluorophenyl)-1,3-thiazol-2-yl]-(2,2-difluoroethyl)amino]-2-ethyl-7-methylpyrazolo[4,3-b]pyridin-5-yl]piperazine-1-carboxylate;2-chloro-1-(3-hydroxyazetidin-1-yl)ethanone;2-[2,2-difluoroethyl-[2-ethyl-5-[4-[2-(3-hydroxyazetidin-1-yl)-2-oxoethyl]piperazin-1-yl]-7-methylpyrazolo[4,3-b]pyridin-3-yl]amino]-4-(4-fluorophenyl)-1,3-thiazole-5-carbonitrile;2-[2,2-difluoroethyl-(2-ethyl-7-methyl-5-piperazin-1-ylpyrazolo[4,3-b]pyridin-3-yl)amino]-4-(4-fluorophenyl)-1,3-thiazole-5-carbonitrile;iodoethane;piperidine?
The canonical SMILES for 2-[(5-bromo-2-ethyl-7-methylpyrazolo[4,3-b]pyridin-3-yl)amino]-4-(4-fluorophenyl)-1,3-thiazole-5-carbonitrile;2-[(5-bromo-2-ethyl-7-methylpyrazolo[4,3-b]pyridin-3-yl)-(2,2-difluoroethyl)amino]-4-(4-fluorophenyl)-1,3-thiazole-5-carbonitrile;tert-butyl 4-[3-[[5-cyano-4-(4-fluorophenyl)-1,3-thiazol-2-yl]-(2,2-difluoroethyl)amino]-2-ethyl-7-methylpyrazolo[4,3-b]pyridin-5-yl]piperazine-1-carboxylate;2-chloro-1-(3-hydroxyazetidin-1-yl)ethanone;2-[2,2-difluoroethyl-[2-ethyl-5-[4-[2-(3-hydroxyazetidin-1-yl)-2-oxoethyl]piperazin-1-yl]-7-methylpyrazolo[4,3-b]pyridin-3-yl]amino]-4-(4-fluorophenyl)-1,3-thiazole-5-carbonitrile;2-[2,2-difluoroethyl-(2-ethyl-7-methyl-5-piperazin-1-ylpyrazolo[4,3-b]pyridin-3-yl)amino]-4-(4-fluorophenyl)-1,3-thiazole-5-carbonitrile;iodoethane;piperidine is C1CCNCC1.CCI.CCn1nc2c(C)cc(Br)nc2c1N(CC(F)F)c1nc(-c2ccc(F)cc2)c(C#N)s1.CCn1nc2c(C)cc(Br)nc2c1Nc1nc(-c2ccc(F)cc2)c(C#N)s1.CCn1nc2c(C)cc(N3CCN(C(=O)OC(C)(C)C)CC3)nc2c1N(CC(F)F)c1nc(-c2ccc(F)cc2)c(C#N)s1.CCn1nc2c(C)cc(N3CCN(CC(=O)N4CC(O)C4)CC3)nc2c1N(CC(F)F)c1nc(-c2ccc(F)cc2)c(C#N)s1.CCn1nc2c(C)cc(N3CCNCC3)nc2c1N(CC(F)F)c1nc(-c2ccc(F)cc2)c(C#N)s1.O=C(CCl)N1CC(O)C1.
What is the InChIKey of 2-[(5-bromo-2-ethyl-7-methylpyrazolo[4,3-b]pyridin-3-yl)amino]-4-(4-fluorophenyl)-1,3-thiazole-5-carbonitrile;2-[(5-bromo-2-ethyl-7-methylpyrazolo[4,3-b]pyridin-3-yl)-(2,2-difluoroethyl)amino]-4-(4-fluorophenyl)-1,3-thiazole-5-carbonitrile;tert-butyl 4-[3-[[5-cyano-4-(4-fluorophenyl)-1,3-thiazol-2-yl]-(2,2-difluoroethyl)amino]-2-ethyl-7-methylpyrazolo[4,3-b]pyridin-5-yl]piperazine-1-carboxylate;2-chloro-1-(3-hydroxyazetidin-1-yl)ethanone;2-[2,2-difluoroethyl-[2-ethyl-5-[4-[2-(3-hydroxyazetidin-1-yl)-2-oxoethyl]piperazin-1-yl]-7-methylpyrazolo[4,3-b]pyridin-3-yl]amino]-4-(4-fluorophenyl)-1,3-thiazole-5-carbonitrile;2-[2,2-difluoroethyl-(2-ethyl-7-methyl-5-piperazin-1-ylpyrazolo[4,3-b]pyridin-3-yl)amino]-4-(4-fluorophenyl)-1,3-thiazole-5-carbonitrile;iodoethane;piperidine?
The InChIKey is GOXKLTORPQGNSY-UHFFFAOYSA-N. The full InChI is InChI=1S/C30H32F3N9O2S.C30H33F3N8O2S.C25H25F3N8S.C21H16BrF3N6S.C19H14BrFN6S.C5H8ClNO2.C5H11N.C2H5I/c1-3-42-29(41(16-23(32)33)30-36-27(22(13-34)45-30)19-4-6-20(31)7-5-19)28-26(37-42)18(2)12-24(35-28)39-10-8-38(9-11-39)17-25(44)40-14-21(43)15-40;1-6-41-27(40(17-22(32)33)28-36-25(21(16-34)44-28)19-7-9-20(31)10-8-19)26-24(37-41)18(2)15-23(35-26)38-11-13-39(14-12-38)29(42)43-30(3,4)5;1-3-36-24(23-21(33-36)15(2)12-20(31-23)34-10-8-30-9-11-34)35(14-19(27)28)25-32-22(18(13-29)37-25)16-4-6-17(26)7-5-16;1-3-31-20(19-17(29-31)11(2)8-15(22)27-19)30(10-16(24)25)21-28-18(14(9-26)32-21)12-4-6-13(23)7-5-12;1-3-27-18(17-15(26-27)10(2)8-14(20)23-17)25-19-24-16(13(9-22)28-19)11-4-6-12(21)7-5-11;6-1-5(9)7-2-4(8)3-7;1-2-4-6-5-3-1;1-2-3/h4-7,12,21,23,43H,3,8-11,14-17H2,1-2H3;7-10,15,22H,6,11-14,17H2,1-5H3;4-7,12,19,30H,3,8-11,14H2,1-2H3;4-8,16H,3,10H2,1-2H3;4-8H,3H2,1-2H3,(H,24,25);4,8H,1-3H2;6H,1-5H2;2H2,1H3.
What are the key properties of 2-[(5-bromo-2-ethyl-7-methylpyrazolo[4,3-b]pyridin-3-yl)amino]-4-(4-fluorophenyl)-1,3-thiazole-5-carbonitrile;2-[(5-bromo-2-ethyl-7-methylpyrazolo[4,3-b]pyridin-3-yl)-(2,2-difluoroethyl)amino]-4-(4-fluorophenyl)-1,3-thiazole-5-carbonitrile;tert-butyl 4-[3-[[5-cyano-4-(4-fluorophenyl)-1,3-thiazol-2-yl]-(2,2-difluoroethyl)amino]-2-ethyl-7-methylpyrazolo[4,3-b]pyridin-5-yl]piperazine-1-carboxylate;2-chloro-1-(3-hydroxyazetidin-1-yl)ethanone;2-[2,2-difluoroethyl-[2-ethyl-5-[4-[2-(3-hydroxyazetidin-1-yl)-2-oxoethyl]piperazin-1-yl]-7-methylpyrazolo[4,3-b]pyridin-3-yl]amino]-4-(4-fluorophenyl)-1,3-thiazole-5-carbonitrile;2-[2,2-difluoroethyl-(2-ethyl-7-methyl-5-piperazin-1-ylpyrazolo[4,3-b]pyridin-3-yl)amino]-4-(4-fluorophenyl)-1,3-thiazole-5-carbonitrile;iodoethane;piperidine?
2-[(5-bromo-2-ethyl-7-methylpyrazolo[4,3-b]pyridin-3-yl)amino]-4-(4-fluorophenyl)-1,3-thiazole-5-carbonitrile;2-[(5-bromo-2-ethyl-7-methylpyrazolo[4,3-b]pyridin-3-yl)-(2,2-difluoroethyl)amino]-4-(4-fluorophenyl)-1,3-thiazole-5-carbonitrile;tert-butyl 4-[3-[[5-cyano-4-(4-fluorophenyl)-1,3-thiazol-2-yl]-(2,2-difluoroethyl)amino]-2-ethyl-7-methylpyrazolo[4,3-b]pyridin-5-yl]piperazine-1-carboxylate;2-chloro-1-(3-hydroxyazetidin-1-yl)ethanone;2-[2,2-difluoroethyl-[2-ethyl-5-[4-[2-(3-hydroxyazetidin-1-yl)-2-oxoethyl]piperazin-1-yl]-7-methylpyrazolo[4,3-b]pyridin-3-yl]amino]-4-(4-fluorophenyl)-1,3-thiazole-5-carbonitrile;2-[2,2-difluoroethyl-(2-ethyl-7-methyl-5-piperazin-1-ylpyrazolo[4,3-b]pyridin-3-yl)amino]-4-(4-fluorophenyl)-1,3-thiazole-5-carbonitrile;iodoethane;piperidine has a molecular weight of 3162.40 g/mol, XLogP of 27.77, 34 rotatable bonds, 5 hydrogen bond donors, and 47 hydrogen bond acceptors.
Where does this data come from?
All data for 2-[(5-bromo-2-ethyl-7-methylpyrazolo[4,3-b]pyridin-3-yl)amino]-4-(4-fluorophenyl)-1,3-thiazole-5-carbonitrile;2-[(5-bromo-2-ethyl-7-methylpyrazolo[4,3-b]pyridin-3-yl)-(2,2-difluoroethyl)amino]-4-(4-fluorophenyl)-1,3-thiazole-5-carbonitrile;tert-butyl 4-[3-[[5-cyano-4-(4-fluorophenyl)-1,3-thiazol-2-yl]-(2,2-difluoroethyl)amino]-2-ethyl-7-methylpyrazolo[4,3-b]pyridin-5-yl]piperazine-1-carboxylate;2-chloro-1-(3-hydroxyazetidin-1-yl)ethanone;2-[2,2-difluoroethyl-[2-ethyl-5-[4-[2-(3-hydroxyazetidin-1-yl)-2-oxoethyl]piperazin-1-yl]-7-methylpyrazolo[4,3-b]pyridin-3-yl]amino]-4-(4-fluorophenyl)-1,3-thiazole-5-carbonitrile;2-[2,2-difluoroethyl-(2-ethyl-7-methyl-5-piperazin-1-ylpyrazolo[4,3-b]pyridin-3-yl)amino]-4-(4-fluorophenyl)-1,3-thiazole-5-carbonitrile;iodoethane;piperidine is sourced from PubChem (CID 158321598), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).