About (5Z)-5-[[2-(4-acetylpiperidin-1-yl)pyrimidin-4-yl]methylidene]-1,3-thiazolidine-2,4-dione;(5Z)-5-[[2-(5-amino-3,4-dihydro-1H-isoquinolin-2-yl)pyrimidin-4-yl]methylidene]thiolane-2,4-dione;(5Z)-5-[[2-[cyclohexyl(methyl)amino]pyrimidin-4-yl]methylidene]thiolane-2,4-dione;(5Z)-5-[[2-(cyclohexylmethyl)pyrimidin-4-yl]methylidene]thiolane-2,4-dione;(5Z)-5-[[2-[4-ethyl-4-(hydroxymethyl)piperidin-1-yl]pyrimidin-4-yl]methylidene]-1,3-thiazolidine-2,4-dione;(5Z)-5-[[2-(3-hydroxypiperidin-1-yl)pyrimidin-4-yl]methylidene]thiolane-2,4-dione;(5Z)-5-[[2-[methyl-[(3S)-1-methylpiperidin-3-yl]amino]pyrimidin-4-yl]methylidene]thiolane-2,4-dione;(5Z)-5-[[2-(3-methylpiperidin-1-yl)pyrimidin-4-yl]methylidene]thiolane-2,4-dione
(5Z)-5-[[2-(4-acetylpiperidin-1-yl)pyrimidin-4-yl]methylidene]-1,3-thiazolidine-2,4-dione;(5Z)-5-[[2-(5-amino-3,4-dihydro-1H-isoquinolin-2-yl)pyrimidin-4-yl]methylidene]thiolane-2,4-dione;(5Z)-5-[[2-[cyclohexyl(methyl)amino]pyrimidin-4-yl]methylidene]thiolane-2,4-dione;(5Z)-5-[[2-(cyclohexylmethyl)pyrimidin-4-yl]methylidene]thiolane-2,4-dione;(5Z)-5-[[2-[4-ethyl-4-(hydroxymethyl)piperidin-1-yl]pyrimidin-4-yl]methylidene]-1,3-thiazolidine-2,4-dione;(5Z)-5-[[2-(3-hydroxypiperidin-1-yl)pyrimidin-4-yl]methylidene]thiolane-2,4-dione;(5Z)-5-[[2-[methyl-[(3S)-1-methylpiperidin-3-yl]amino]pyrimidin-4-yl]methylidene]thiolane-2,4-dione;(5Z)-5-[[2-(3-methylpiperidin-1-yl)pyrimidin-4-yl]methylidene]thiolane-2,4-dione (PubChem CID 159148411) has the molecular formula C126H141N27O19S8
and a molecular weight of 2594.22 g/mol. Its IUPAC name is (5Z)-5-[[2-(4-acetylpiperidin-1-yl)pyrimidin-4-yl]methylidene]-1,3-thiazolidine-2,4-dione;(5Z)-5-[[2-(5-amino-3,4-dihydro-1H-isoquinolin-2-yl)pyrimidin-4-yl]methylidene]thiolane-2,4-dione;(5Z)-5-[[2-[cyclohexyl(methyl)amino]pyrimidin-4-yl]methylidene]thiolane-2,4-dione;(5Z)-5-[[2-(cyclohexylmethyl)pyrimidin-4-yl]methylidene]thiolane-2,4-dione;(5Z)-5-[[2-[4-ethyl-4-(hydroxymethyl)piperidin-1-yl]pyrimidin-4-yl]methylidene]-1,3-thiazolidine-2,4-dione;(5Z)-5-[[2-(3-hydroxypiperidin-1-yl)pyrimidin-4-yl]methylidene]thiolane-2,4-dione;(5Z)-5-[[2-[methyl-[(3S)-1-methylpiperidin-3-yl]amino]pyrimidin-4-yl]methylidene]thiolane-2,4-dione;(5Z)-5-[[2-(3-methylpiperidin-1-yl)pyrimidin-4-yl]methylidene]thiolane-2,4-dione.
Frequently Asked Questions
What is the IUPAC name of (5Z)-5-[[2-(4-acetylpiperidin-1-yl)pyrimidin-4-yl]methylidene]-1,3-thiazolidine-2,4-dione;(5Z)-5-[[2-(5-amino-3,4-dihydro-1H-isoquinolin-2-yl)pyrimidin-4-yl]methylidene]thiolane-2,4-dione;(5Z)-5-[[2-[cyclohexyl(methyl)amino]pyrimidin-4-yl]methylidene]thiolane-2,4-dione;(5Z)-5-[[2-(cyclohexylmethyl)pyrimidin-4-yl]methylidene]thiolane-2,4-dione;(5Z)-5-[[2-[4-ethyl-4-(hydroxymethyl)piperidin-1-yl]pyrimidin-4-yl]methylidene]-1,3-thiazolidine-2,4-dione;(5Z)-5-[[2-(3-hydroxypiperidin-1-yl)pyrimidin-4-yl]methylidene]thiolane-2,4-dione;(5Z)-5-[[2-[methyl-[(3S)-1-methylpiperidin-3-yl]amino]pyrimidin-4-yl]methylidene]thiolane-2,4-dione;(5Z)-5-[[2-(3-methylpiperidin-1-yl)pyrimidin-4-yl]methylidene]thiolane-2,4-dione?
The IUPAC name of (5Z)-5-[[2-(4-acetylpiperidin-1-yl)pyrimidin-4-yl]methylidene]-1,3-thiazolidine-2,4-dione;(5Z)-5-[[2-(5-amino-3,4-dihydro-1H-isoquinolin-2-yl)pyrimidin-4-yl]methylidene]thiolane-2,4-dione;(5Z)-5-[[2-[cyclohexyl(methyl)amino]pyrimidin-4-yl]methylidene]thiolane-2,4-dione;(5Z)-5-[[2-(cyclohexylmethyl)pyrimidin-4-yl]methylidene]thiolane-2,4-dione;(5Z)-5-[[2-[4-ethyl-4-(hydroxymethyl)piperidin-1-yl]pyrimidin-4-yl]methylidene]-1,3-thiazolidine-2,4-dione;(5Z)-5-[[2-(3-hydroxypiperidin-1-yl)pyrimidin-4-yl]methylidene]thiolane-2,4-dione;(5Z)-5-[[2-[methyl-[(3S)-1-methylpiperidin-3-yl]amino]pyrimidin-4-yl]methylidene]thiolane-2,4-dione;(5Z)-5-[[2-(3-methylpiperidin-1-yl)pyrimidin-4-yl]methylidene]thiolane-2,4-dione (CID 159148411) is (5Z)-5-[[2-(4-acetylpiperidin-1-yl)pyrimidin-4-yl]methylidene]-1,3-thiazolidine-2,4-dione;(5Z)-5-[[2-(5-amino-3,4-dihydro-1H-isoquinolin-2-yl)pyrimidin-4-yl]methylidene]thiolane-2,4-dione;(5Z)-5-[[2-[cyclohexyl(methyl)amino]pyrimidin-4-yl]methylidene]thiolane-2,4-dione;(5Z)-5-[[2-(cyclohexylmethyl)pyrimidin-4-yl]methylidene]thiolane-2,4-dione;(5Z)-5-[[2-[4-ethyl-4-(hydroxymethyl)piperidin-1-yl]pyrimidin-4-yl]methylidene]-1,3-thiazolidine-2,4-dione;(5Z)-5-[[2-(3-hydroxypiperidin-1-yl)pyrimidin-4-yl]methylidene]thiolane-2,4-dione;(5Z)-5-[[2-[methyl-[(3S)-1-methylpiperidin-3-yl]amino]pyrimidin-4-yl]methylidene]thiolane-2,4-dione;(5Z)-5-[[2-(3-methylpiperidin-1-yl)pyrimidin-4-yl]methylidene]thiolane-2,4-dione.
What is the SMILES notation for (5Z)-5-[[2-(4-acetylpiperidin-1-yl)pyrimidin-4-yl]methylidene]-1,3-thiazolidine-2,4-dione;(5Z)-5-[[2-(5-amino-3,4-dihydro-1H-isoquinolin-2-yl)pyrimidin-4-yl]methylidene]thiolane-2,4-dione;(5Z)-5-[[2-[cyclohexyl(methyl)amino]pyrimidin-4-yl]methylidene]thiolane-2,4-dione;(5Z)-5-[[2-(cyclohexylmethyl)pyrimidin-4-yl]methylidene]thiolane-2,4-dione;(5Z)-5-[[2-[4-ethyl-4-(hydroxymethyl)piperidin-1-yl]pyrimidin-4-yl]methylidene]-1,3-thiazolidine-2,4-dione;(5Z)-5-[[2-(3-hydroxypiperidin-1-yl)pyrimidin-4-yl]methylidene]thiolane-2,4-dione;(5Z)-5-[[2-[methyl-[(3S)-1-methylpiperidin-3-yl]amino]pyrimidin-4-yl]methylidene]thiolane-2,4-dione;(5Z)-5-[[2-(3-methylpiperidin-1-yl)pyrimidin-4-yl]methylidene]thiolane-2,4-dione?
The canonical SMILES for (5Z)-5-[[2-(4-acetylpiperidin-1-yl)pyrimidin-4-yl]methylidene]-1,3-thiazolidine-2,4-dione;(5Z)-5-[[2-(5-amino-3,4-dihydro-1H-isoquinolin-2-yl)pyrimidin-4-yl]methylidene]thiolane-2,4-dione;(5Z)-5-[[2-[cyclohexyl(methyl)amino]pyrimidin-4-yl]methylidene]thiolane-2,4-dione;(5Z)-5-[[2-(cyclohexylmethyl)pyrimidin-4-yl]methylidene]thiolane-2,4-dione;(5Z)-5-[[2-[4-ethyl-4-(hydroxymethyl)piperidin-1-yl]pyrimidin-4-yl]methylidene]-1,3-thiazolidine-2,4-dione;(5Z)-5-[[2-(3-hydroxypiperidin-1-yl)pyrimidin-4-yl]methylidene]thiolane-2,4-dione;(5Z)-5-[[2-[methyl-[(3S)-1-methylpiperidin-3-yl]amino]pyrimidin-4-yl]methylidene]thiolane-2,4-dione;(5Z)-5-[[2-(3-methylpiperidin-1-yl)pyrimidin-4-yl]methylidene]thiolane-2,4-dione is CC(=O)C1CCN(c2nccc(/C=C3\SC(=O)NC3=O)n2)CC1.CC1CCCN(c2nccc(/C=C3\SC(=O)CC3=O)n2)C1.CCC1(CO)CCN(c2nccc(/C=C3\SC(=O)NC3=O)n2)CC1.CN(c1nccc(/C=C2\SC(=O)CC2=O)n1)C1CCCCC1.CN1CCC[C@H](N(C)c2nccc(/C=C3\SC(=O)CC3=O)n2)C1.Nc1cccc2c1CCN(c1nccc(/C=C3\SC(=O)CC3=O)n1)C2.O=C1CC(=O)/C(=C/c2ccnc(CC3CCCCC3)n2)S1.O=C1CC(=O)/C(=C/c2ccnc(N3CCCC(O)C3)n2)S1.
What is the InChIKey of (5Z)-5-[[2-(4-acetylpiperidin-1-yl)pyrimidin-4-yl]methylidene]-1,3-thiazolidine-2,4-dione;(5Z)-5-[[2-(5-amino-3,4-dihydro-1H-isoquinolin-2-yl)pyrimidin-4-yl]methylidene]thiolane-2,4-dione;(5Z)-5-[[2-[cyclohexyl(methyl)amino]pyrimidin-4-yl]methylidene]thiolane-2,4-dione;(5Z)-5-[[2-(cyclohexylmethyl)pyrimidin-4-yl]methylidene]thiolane-2,4-dione;(5Z)-5-[[2-[4-ethyl-4-(hydroxymethyl)piperidin-1-yl]pyrimidin-4-yl]methylidene]-1,3-thiazolidine-2,4-dione;(5Z)-5-[[2-(3-hydroxypiperidin-1-yl)pyrimidin-4-yl]methylidene]thiolane-2,4-dione;(5Z)-5-[[2-[methyl-[(3S)-1-methylpiperidin-3-yl]amino]pyrimidin-4-yl]methylidene]thiolane-2,4-dione;(5Z)-5-[[2-(3-methylpiperidin-1-yl)pyrimidin-4-yl]methylidene]thiolane-2,4-dione?
The InChIKey is KIYXLAATUOGSGP-ROWMWFKMSA-N. The full InChI is InChI=1S/C18H16N4O2S.C16H20N4O3S.C16H20N4O2S.C16H19N3O2S.C16H18N2O2S.C15H16N4O3S.C15H17N3O2S.C14H15N3O3S/c19-14-3-1-2-11-10-22(7-5-13(11)14)18-20-6-4-12(21-18)8-16-15(23)9-17(24)25-16;1-2-16(10-21)4-7-20(8-5-16)14-17-6-3-11(18-14)9-12-13(22)19-15(23)24-12;1-19-7-3-4-12(10-19)20(2)16-17-6-5-11(18-16)8-14-13(21)9-15(22)23-14;1-19(12-5-3-2-4-6-12)16-17-8-7-11(18-16)9-14-13(20)10-15(21)22-14;19-13-10-16(20)21-14(13)9-12-6-7-17-15(18-12)8-11-4-2-1-3-5-11;1-9(20)10-3-6-19(7-4-10)14-16-5-2-11(17-14)8-12-13(21)18-15(22)23-12;1-10-3-2-6-18(9-10)15-16-5-4-11(17-15)7-13-12(19)8-14(20)21-13;18-10-2-1-5-17(8-10)14-15-4-3-9(16-14)6-12-11(19)7-13(20)21-12/h1-4,6,8H,5,7,9-10,19H2;3,6,9,21H,2,4-5,7-8,10H2,1H3,(H,19,22,23);5-6,8,12H,3-4,7,9-10H2,1-2H3;7-9,12H,2-6,10H2,1H3;6-7,9,11H,1-5,8,10H2;2,5,8,10H,3-4,6-7H2,1H3,(H,18,21,22);4-5,7,10H,2-3,6,8-9H2,1H3;3-4,6,10,18H,1-2,5,7-8H2/b16-8-;12-9-;14-8-;2*14-9-;12-8-;13-7-;12-6-/t;;12-;;;;;/m..0...../s1.
What are the key properties of (5Z)-5-[[2-(4-acetylpiperidin-1-yl)pyrimidin-4-yl]methylidene]-1,3-thiazolidine-2,4-dione;(5Z)-5-[[2-(5-amino-3,4-dihydro-1H-isoquinolin-2-yl)pyrimidin-4-yl]methylidene]thiolane-2,4-dione;(5Z)-5-[[2-[cyclohexyl(methyl)amino]pyrimidin-4-yl]methylidene]thiolane-2,4-dione;(5Z)-5-[[2-(cyclohexylmethyl)pyrimidin-4-yl]methylidene]thiolane-2,4-dione;(5Z)-5-[[2-[4-ethyl-4-(hydroxymethyl)piperidin-1-yl]pyrimidin-4-yl]methylidene]-1,3-thiazolidine-2,4-dione;(5Z)-5-[[2-(3-hydroxypiperidin-1-yl)pyrimidin-4-yl]methylidene]thiolane-2,4-dione;(5Z)-5-[[2-[methyl-[(3S)-1-methylpiperidin-3-yl]amino]pyrimidin-4-yl]methylidene]thiolane-2,4-dione;(5Z)-5-[[2-(3-methylpiperidin-1-yl)pyrimidin-4-yl]methylidene]thiolane-2,4-dione?
(5Z)-5-[[2-(4-acetylpiperidin-1-yl)pyrimidin-4-yl]methylidene]-1,3-thiazolidine-2,4-dione;(5Z)-5-[[2-(5-amino-3,4-dihydro-1H-isoquinolin-2-yl)pyrimidin-4-yl]methylidene]thiolane-2,4-dione;(5Z)-5-[[2-[cyclohexyl(methyl)amino]pyrimidin-4-yl]methylidene]thiolane-2,4-dione;(5Z)-5-[[2-(cyclohexylmethyl)pyrimidin-4-yl]methylidene]thiolane-2,4-dione;(5Z)-5-[[2-[4-ethyl-4-(hydroxymethyl)piperidin-1-yl]pyrimidin-4-yl]methylidene]-1,3-thiazolidine-2,4-dione;(5Z)-5-[[2-(3-hydroxypiperidin-1-yl)pyrimidin-4-yl]methylidene]thiolane-2,4-dione;(5Z)-5-[[2-[methyl-[(3S)-1-methylpiperidin-3-yl]amino]pyrimidin-4-yl]methylidene]thiolane-2,4-dione;(5Z)-5-[[2-(3-methylpiperidin-1-yl)pyrimidin-4-yl]methylidene]thiolane-2,4-dione has a molecular weight of 2594.22 g/mol, XLogP of 16.46, 22 rotatable bonds, 5 hydrogen bond donors, and 52 hydrogen bond acceptors.
Where does this data come from?
All data for (5Z)-5-[[2-(4-acetylpiperidin-1-yl)pyrimidin-4-yl]methylidene]-1,3-thiazolidine-2,4-dione;(5Z)-5-[[2-(5-amino-3,4-dihydro-1H-isoquinolin-2-yl)pyrimidin-4-yl]methylidene]thiolane-2,4-dione;(5Z)-5-[[2-[cyclohexyl(methyl)amino]pyrimidin-4-yl]methylidene]thiolane-2,4-dione;(5Z)-5-[[2-(cyclohexylmethyl)pyrimidin-4-yl]methylidene]thiolane-2,4-dione;(5Z)-5-[[2-[4-ethyl-4-(hydroxymethyl)piperidin-1-yl]pyrimidin-4-yl]methylidene]-1,3-thiazolidine-2,4-dione;(5Z)-5-[[2-(3-hydroxypiperidin-1-yl)pyrimidin-4-yl]methylidene]thiolane-2,4-dione;(5Z)-5-[[2-[methyl-[(3S)-1-methylpiperidin-3-yl]amino]pyrimidin-4-yl]methylidene]thiolane-2,4-dione;(5Z)-5-[[2-(3-methylpiperidin-1-yl)pyrimidin-4-yl]methylidene]thiolane-2,4-dione is sourced from PubChem (CID 159148411), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).