About 6-chloro-N-[(2S)-2-(hydroxymethyl)-2-methyl-6-morpholin-4-yl-3H-1-benzofuran-5-yl]thieno[3,2-b]pyridine-3-carboxamide;6-cyano-N-[2-(hydroxymethyl)-2-methyl-6-morpholin-4-yl-3H-1-benzofuran-5-yl]thieno[3,2-b]pyridine-3-carboxamide;1-(2-cyano-4-pyridinyl)-N-(2,2-dimethyl-6-morpholin-4-yl-3H-1-benzofuran-5-yl)pyrazole-3-carboxamide;N-(2,2-dimethyl-6-morpholin-4-yl-3H-1-benzofuran-5-yl)-1-[2-(2-hydroxypropan-2-yl)-4-pyridinyl]pyrazole-3-carboxamide;N-(2,2-dimethyl-6-morpholin-4-yl-3H-1-benzofuran-5-yl)-1-[2-(2,2,2-trifluoroethylamino)-4-pyridinyl]pyrazole-3-carboxamide
6-chloro-N-[(2S)-2-(hydroxymethyl)-2-methyl-6-morpholin-4-yl-3H-1-benzofuran-5-yl]thieno[3,2-b]pyridine-3-carboxamide;6-cyano-N-[2-(hydroxymethyl)-2-methyl-6-morpholin-4-yl-3H-1-benzofuran-5-yl]thieno[3,2-b]pyridine-3-carboxamide;1-(2-cyano-4-pyridinyl)-N-(2,2-dimethyl-6-morpholin-4-yl-3H-1-benzofuran-5-yl)pyrazole-3-carboxamide;N-(2,2-dimethyl-6-morpholin-4-yl-3H-1-benzofuran-5-yl)-1-[2-(2-hydroxypropan-2-yl)-4-pyridinyl]pyrazole-3-carboxamide;N-(2,2-dimethyl-6-morpholin-4-yl-3H-1-benzofuran-5-yl)-1-[2-(2,2,2-trifluoroethylamino)-4-pyridinyl]pyrazole-3-carboxamide (PubChem CID 158439811) has the molecular formula C120H126ClF3N24O18S2
and a molecular weight of 2349.06 g/mol. Its IUPAC name is 6-chloro-N-[(2S)-2-(hydroxymethyl)-2-methyl-6-morpholin-4-yl-3H-1-benzofuran-5-yl]thieno[3,2-b]pyridine-3-carboxamide;6-cyano-N-[2-(hydroxymethyl)-2-methyl-6-morpholin-4-yl-3H-1-benzofuran-5-yl]thieno[3,2-b]pyridine-3-carboxamide;1-(2-cyano-4-pyridinyl)-N-(2,2-dimethyl-6-morpholin-4-yl-3H-1-benzofuran-5-yl)pyrazole-3-carboxamide;N-(2,2-dimethyl-6-morpholin-4-yl-3H-1-benzofuran-5-yl)-1-[2-(2-hydroxypropan-2-yl)-4-pyridinyl]pyrazole-3-carboxamide;N-(2,2-dimethyl-6-morpholin-4-yl-3H-1-benzofuran-5-yl)-1-[2-(2,2,2-trifluoroethylamino)-4-pyridinyl]pyrazole-3-carboxamide.
Frequently Asked Questions
What is the IUPAC name of 6-chloro-N-[(2S)-2-(hydroxymethyl)-2-methyl-6-morpholin-4-yl-3H-1-benzofuran-5-yl]thieno[3,2-b]pyridine-3-carboxamide;6-cyano-N-[2-(hydroxymethyl)-2-methyl-6-morpholin-4-yl-3H-1-benzofuran-5-yl]thieno[3,2-b]pyridine-3-carboxamide;1-(2-cyano-4-pyridinyl)-N-(2,2-dimethyl-6-morpholin-4-yl-3H-1-benzofuran-5-yl)pyrazole-3-carboxamide;N-(2,2-dimethyl-6-morpholin-4-yl-3H-1-benzofuran-5-yl)-1-[2-(2-hydroxypropan-2-yl)-4-pyridinyl]pyrazole-3-carboxamide;N-(2,2-dimethyl-6-morpholin-4-yl-3H-1-benzofuran-5-yl)-1-[2-(2,2,2-trifluoroethylamino)-4-pyridinyl]pyrazole-3-carboxamide?
The IUPAC name of 6-chloro-N-[(2S)-2-(hydroxymethyl)-2-methyl-6-morpholin-4-yl-3H-1-benzofuran-5-yl]thieno[3,2-b]pyridine-3-carboxamide;6-cyano-N-[2-(hydroxymethyl)-2-methyl-6-morpholin-4-yl-3H-1-benzofuran-5-yl]thieno[3,2-b]pyridine-3-carboxamide;1-(2-cyano-4-pyridinyl)-N-(2,2-dimethyl-6-morpholin-4-yl-3H-1-benzofuran-5-yl)pyrazole-3-carboxamide;N-(2,2-dimethyl-6-morpholin-4-yl-3H-1-benzofuran-5-yl)-1-[2-(2-hydroxypropan-2-yl)-4-pyridinyl]pyrazole-3-carboxamide;N-(2,2-dimethyl-6-morpholin-4-yl-3H-1-benzofuran-5-yl)-1-[2-(2,2,2-trifluoroethylamino)-4-pyridinyl]pyrazole-3-carboxamide (CID 158439811) is 6-chloro-N-[(2S)-2-(hydroxymethyl)-2-methyl-6-morpholin-4-yl-3H-1-benzofuran-5-yl]thieno[3,2-b]pyridine-3-carboxamide;6-cyano-N-[2-(hydroxymethyl)-2-methyl-6-morpholin-4-yl-3H-1-benzofuran-5-yl]thieno[3,2-b]pyridine-3-carboxamide;1-(2-cyano-4-pyridinyl)-N-(2,2-dimethyl-6-morpholin-4-yl-3H-1-benzofuran-5-yl)pyrazole-3-carboxamide;N-(2,2-dimethyl-6-morpholin-4-yl-3H-1-benzofuran-5-yl)-1-[2-(2-hydroxypropan-2-yl)-4-pyridinyl]pyrazole-3-carboxamide;N-(2,2-dimethyl-6-morpholin-4-yl-3H-1-benzofuran-5-yl)-1-[2-(2,2,2-trifluoroethylamino)-4-pyridinyl]pyrazole-3-carboxamide.
What is the SMILES notation for 6-chloro-N-[(2S)-2-(hydroxymethyl)-2-methyl-6-morpholin-4-yl-3H-1-benzofuran-5-yl]thieno[3,2-b]pyridine-3-carboxamide;6-cyano-N-[2-(hydroxymethyl)-2-methyl-6-morpholin-4-yl-3H-1-benzofuran-5-yl]thieno[3,2-b]pyridine-3-carboxamide;1-(2-cyano-4-pyridinyl)-N-(2,2-dimethyl-6-morpholin-4-yl-3H-1-benzofuran-5-yl)pyrazole-3-carboxamide;N-(2,2-dimethyl-6-morpholin-4-yl-3H-1-benzofuran-5-yl)-1-[2-(2-hydroxypropan-2-yl)-4-pyridinyl]pyrazole-3-carboxamide;N-(2,2-dimethyl-6-morpholin-4-yl-3H-1-benzofuran-5-yl)-1-[2-(2,2,2-trifluoroethylamino)-4-pyridinyl]pyrazole-3-carboxamide?
The canonical SMILES for 6-chloro-N-[(2S)-2-(hydroxymethyl)-2-methyl-6-morpholin-4-yl-3H-1-benzofuran-5-yl]thieno[3,2-b]pyridine-3-carboxamide;6-cyano-N-[2-(hydroxymethyl)-2-methyl-6-morpholin-4-yl-3H-1-benzofuran-5-yl]thieno[3,2-b]pyridine-3-carboxamide;1-(2-cyano-4-pyridinyl)-N-(2,2-dimethyl-6-morpholin-4-yl-3H-1-benzofuran-5-yl)pyrazole-3-carboxamide;N-(2,2-dimethyl-6-morpholin-4-yl-3H-1-benzofuran-5-yl)-1-[2-(2-hydroxypropan-2-yl)-4-pyridinyl]pyrazole-3-carboxamide;N-(2,2-dimethyl-6-morpholin-4-yl-3H-1-benzofuran-5-yl)-1-[2-(2,2,2-trifluoroethylamino)-4-pyridinyl]pyrazole-3-carboxamide is CC1(C)Cc2cc(NC(=O)c3ccn(-c4ccnc(C#N)c4)n3)c(N3CCOCC3)cc2O1.CC1(C)Cc2cc(NC(=O)c3ccn(-c4ccnc(C(C)(C)O)c4)n3)c(N3CCOCC3)cc2O1.CC1(C)Cc2cc(NC(=O)c3ccn(-c4ccnc(NCC(F)(F)F)c4)n3)c(N3CCOCC3)cc2O1.CC1(CO)Cc2cc(NC(=O)c3csc4cc(C#N)cnc34)c(N3CCOCC3)cc2O1.C[C@@]1(CO)Cc2cc(NC(=O)c3csc4cc(Cl)cnc34)c(N3CCOCC3)cc2O1.
What is the InChIKey of 6-chloro-N-[(2S)-2-(hydroxymethyl)-2-methyl-6-morpholin-4-yl-3H-1-benzofuran-5-yl]thieno[3,2-b]pyridine-3-carboxamide;6-cyano-N-[2-(hydroxymethyl)-2-methyl-6-morpholin-4-yl-3H-1-benzofuran-5-yl]thieno[3,2-b]pyridine-3-carboxamide;1-(2-cyano-4-pyridinyl)-N-(2,2-dimethyl-6-morpholin-4-yl-3H-1-benzofuran-5-yl)pyrazole-3-carboxamide;N-(2,2-dimethyl-6-morpholin-4-yl-3H-1-benzofuran-5-yl)-1-[2-(2-hydroxypropan-2-yl)-4-pyridinyl]pyrazole-3-carboxamide;N-(2,2-dimethyl-6-morpholin-4-yl-3H-1-benzofuran-5-yl)-1-[2-(2,2,2-trifluoroethylamino)-4-pyridinyl]pyrazole-3-carboxamide?
The InChIKey is HCRFYFHAVCYYEZ-MFRJVMNVSA-N. The full InChI is InChI=1S/C26H31N5O4.C25H27F3N6O3.C24H24N6O3.C23H22N4O4S.C22H22ClN3O4S/c1-25(2)16-17-13-20(21(15-22(17)35-25)30-9-11-34-12-10-30)28-24(32)19-6-8-31(29-19)18-5-7-27-23(14-18)26(3,4)33;1-24(2)14-16-11-19(20(13-21(16)37-24)33-7-9-36-10-8-33)31-23(35)18-4-6-34(32-18)17-3-5-29-22(12-17)30-15-25(26,27)28;1-24(2)14-16-11-20(21(13-22(16)33-24)29-7-9-32-10-8-29)27-23(31)19-4-6-30(28-19)18-3-5-26-17(12-18)15-25;1-23(13-28)9-15-7-17(18(8-19(15)31-23)27-2-4-30-5-3-27)26-22(29)16-12-32-20-6-14(10-24)11-25-21(16)20;1-22(12-27)9-13-6-16(17(8-18(13)30-22)26-2-4-29-5-3-26)25-21(28)15-11-31-19-7-14(23)10-24-20(15)19/h5-8,13-15,33H,9-12,16H2,1-4H3,(H,28,32);3-6,11-13H,7-10,14-15H2,1-2H3,(H,29,30)(H,31,35);3-6,11-13H,7-10,14H2,1-2H3,(H,27,31);6-8,11-12,28H,2-5,9,13H2,1H3,(H,26,29);6-8,10-11,27H,2-5,9,12H2,1H3,(H,25,28)/t;;;;22-/m....0/s1.
What are the key properties of 6-chloro-N-[(2S)-2-(hydroxymethyl)-2-methyl-6-morpholin-4-yl-3H-1-benzofuran-5-yl]thieno[3,2-b]pyridine-3-carboxamide;6-cyano-N-[2-(hydroxymethyl)-2-methyl-6-morpholin-4-yl-3H-1-benzofuran-5-yl]thieno[3,2-b]pyridine-3-carboxamide;1-(2-cyano-4-pyridinyl)-N-(2,2-dimethyl-6-morpholin-4-yl-3H-1-benzofuran-5-yl)pyrazole-3-carboxamide;N-(2,2-dimethyl-6-morpholin-4-yl-3H-1-benzofuran-5-yl)-1-[2-(2-hydroxypropan-2-yl)-4-pyridinyl]pyrazole-3-carboxamide;N-(2,2-dimethyl-6-morpholin-4-yl-3H-1-benzofuran-5-yl)-1-[2-(2,2,2-trifluoroethylamino)-4-pyridinyl]pyrazole-3-carboxamide?
6-chloro-N-[(2S)-2-(hydroxymethyl)-2-methyl-6-morpholin-4-yl-3H-1-benzofuran-5-yl]thieno[3,2-b]pyridine-3-carboxamide;6-cyano-N-[2-(hydroxymethyl)-2-methyl-6-morpholin-4-yl-3H-1-benzofuran-5-yl]thieno[3,2-b]pyridine-3-carboxamide;1-(2-cyano-4-pyridinyl)-N-(2,2-dimethyl-6-morpholin-4-yl-3H-1-benzofuran-5-yl)pyrazole-3-carboxamide;N-(2,2-dimethyl-6-morpholin-4-yl-3H-1-benzofuran-5-yl)-1-[2-(2-hydroxypropan-2-yl)-4-pyridinyl]pyrazole-3-carboxamide;N-(2,2-dimethyl-6-morpholin-4-yl-3H-1-benzofuran-5-yl)-1-[2-(2,2,2-trifluoroethylamino)-4-pyridinyl]pyrazole-3-carboxamide has a molecular weight of 2349.06 g/mol, XLogP of 16.95, 23 rotatable bonds, 9 hydrogen bond donors, and 39 hydrogen bond acceptors.
Where does this data come from?
All data for 6-chloro-N-[(2S)-2-(hydroxymethyl)-2-methyl-6-morpholin-4-yl-3H-1-benzofuran-5-yl]thieno[3,2-b]pyridine-3-carboxamide;6-cyano-N-[2-(hydroxymethyl)-2-methyl-6-morpholin-4-yl-3H-1-benzofuran-5-yl]thieno[3,2-b]pyridine-3-carboxamide;1-(2-cyano-4-pyridinyl)-N-(2,2-dimethyl-6-morpholin-4-yl-3H-1-benzofuran-5-yl)pyrazole-3-carboxamide;N-(2,2-dimethyl-6-morpholin-4-yl-3H-1-benzofuran-5-yl)-1-[2-(2-hydroxypropan-2-yl)-4-pyridinyl]pyrazole-3-carboxamide;N-(2,2-dimethyl-6-morpholin-4-yl-3H-1-benzofuran-5-yl)-1-[2-(2,2,2-trifluoroethylamino)-4-pyridinyl]pyrazole-3-carboxamide is sourced from PubChem (CID 158439811), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).