(5Z)-5-[[2-[[4-[[4-fluoro-2-(furan-3-yl)phenyl]methylamino]cyclohexyl]methyl]pyrimidin-4-yl]methylidene]-1,3-thiazolidine-2,4-dione;(5Z)-5-[[2-[[4-[(4-fluoro-2-pyridin-3-ylphenyl)methylamino]cyclohexyl]methyl]pyrimidin-4-yl]methylidene]-1,3-thiazolidine-2,4-dione;(5Z)-5-[[2-[[4-[2-(1H-indol-2-yl)ethylamino]cyclohexyl]methyl]pyrimidin-4-yl]methylidene]-1,3-thiazolidine-2,4-dione;(5Z)-5-[[2-[[4-[2-(4-isocyanophenyl)ethylamino]cyclohexyl]methyl]pyrimidin-4-yl]methylidene]-1,3-thiazolidine-2,4-dione;(5Z)-5-[[2-[[4-[2-(5-methyl-2-phenyl-1,3-oxazol-4-yl)ethylamino]cyclohexyl]methyl]pyrimidin-4-yl]methylidene]-1,3-thiazolidine-2,4-dione;(5Z)-5-[[2-[[4-[2-(2-methyl-1,3-thiazol-4-yl)ethylamino]cyclohexyl]methyl]pyrimidin-4-yl]methylidene]-1,3-thiazolidine-2,4-dione;(5Z)-5-[[2-[[4-(2-quinoxalin-6-ylethylamino)cyclohexyl]methyl]pyrimidin-4-yl]methylidene]-1,3-thiazolidine-2,4-dione;(5Z)-5-[[2-[[4-[2-([1,2,4]triazolo[1,5-a]pyrimidin-5-yl)ethylamino]cyclohexyl]methyl]pyrimidin-4-yl]methylidene]-1,3-thiazolidine-2,4-dione

C197H207F2N43O18S9 — CID 157240058

About (5Z)-5-[[2-[[4-[[4-fluoro-2-(furan-3-yl)phenyl]methylamino]cyclohexyl]methyl]pyrimidin-4-yl]methylidene]-1,3-thiazolidine-2,4-dione;(5Z)-5-[[2-[[4-[(4-fluoro-2-pyridin-3-ylphenyl)methylamino]cyclohexyl]methyl]pyrimidin-4-yl]methylidene]-1,3-thiazolidine-2,4-dione;(5Z)-5-[[2-[[4-[2-(1H-indol-2-yl)ethylamino]cyclohexyl]methyl]pyrimidin-4-yl]methylidene]-1,3-thiazolidine-2,4-dione;(5Z)-5-[[2-[[4-[2-(4-isocyanophenyl)ethylamino]cyclohexyl]methyl]pyrimidin-4-yl]methylidene]-1,3-thiazolidine-2,4-dione;(5Z)-5-[[2-[[4-[2-(5-methyl-2-phenyl-1,3-oxazol-4-yl)ethylamino]cyclohexyl]methyl]pyrimidin-4-yl]methylidene]-1,3-thiazolidine-2,4-dione;(5Z)-5-[[2-[[4-[2-(2-methyl-1,3-thiazol-4-yl)ethylamino]cyclohexyl]methyl]pyrimidin-4-yl]methylidene]-1,3-thiazolidine-2,4-dione;(5Z)-5-[[2-[[4-(2-quinoxalin-6-ylethylamino)cyclohexyl]methyl]pyrimidin-4-yl]methylidene]-1,3-thiazolidine-2,4-dione;(5Z)-5-[[2-[[4-[2-([1,2,4]triazolo[1,5-a]pyrimidin-5-yl)ethylamino]cyclohexyl]methyl]pyrimidin-4-yl]methylidene]-1,3-thiazolidine-2,4-dione

(5Z)-5-[[2-[[4-[[4-fluoro-2-(furan-3-yl)phenyl]methylamino]cyclohexyl]methyl]pyrimidin-4-yl]methylidene]-1,3-thiazolidine-2,4-dione;(5Z)-5-[[2-[[4-[(4-fluoro-2-pyridin-3-ylphenyl)methylamino]cyclohexyl]methyl]pyrimidin-4-yl]methylidene]-1,3-thiazolidine-2,4-dione;(5Z)-5-[[2-[[4-[2-(1H-indol-2-yl)ethylamino]cyclohexyl]methyl]pyrimidin-4-yl]methylidene]-1,3-thiazolidine-2,4-dione;(5Z)-5-[[2-[[4-[2-(4-isocyanophenyl)ethylamino]cyclohexyl]methyl]pyrimidin-4-yl]methylidene]-1,3-thiazolidine-2,4-dione;(5Z)-5-[[2-[[4-[2-(5-methyl-2-phenyl-1,3-oxazol-4-yl)ethylamino]cyclohexyl]methyl]pyrimidin-4-yl]methylidene]-1,3-thiazolidine-2,4-dione;(5Z)-5-[[2-[[4-[2-(2-methyl-1,3-thiazol-4-yl)ethylamino]cyclohexyl]methyl]pyrimidin-4-yl]methylidene]-1,3-thiazolidine-2,4-dione;(5Z)-5-[[2-[[4-(2-quinoxalin-6-ylethylamino)cyclohexyl]methyl]pyrimidin-4-yl]methylidene]-1,3-thiazolidine-2,4-dione;(5Z)-5-[[2-[[4-[2-([1,2,4]triazolo[1,5-a]pyrimidin-5-yl)ethylamino]cyclohexyl]methyl]pyrimidin-4-yl]methylidene]-1,3-thiazolidine-2,4-dione (PubChem CID 157240058) has the molecular formula C197H207F2N43O18S9 and a molecular weight of 3791.70 g/mol. Its IUPAC name is (5Z)-5-[[2-[[4-[[4-fluoro-2-(furan-3-yl)phenyl]methylamino]cyclohexyl]methyl]pyrimidin-4-yl]methylidene]-1,3-thiazolidine-2,4-dione;(5Z)-5-[[2-[[4-[(4-fluoro-2-pyridin-3-ylphenyl)methylamino]cyclohexyl]methyl]pyrimidin-4-yl]methylidene]-1,3-thiazolidine-2,4-dione;(5Z)-5-[[2-[[4-[2-(1H-indol-2-yl)ethylamino]cyclohexyl]methyl]pyrimidin-4-yl]methylidene]-1,3-thiazolidine-2,4-dione;(5Z)-5-[[2-[[4-[2-(4-isocyanophenyl)ethylamino]cyclohexyl]methyl]pyrimidin-4-yl]methylidene]-1,3-thiazolidine-2,4-dione;(5Z)-5-[[2-[[4-[2-(5-methyl-2-phenyl-1,3-oxazol-4-yl)ethylamino]cyclohexyl]methyl]pyrimidin-4-yl]methylidene]-1,3-thiazolidine-2,4-dione;(5Z)-5-[[2-[[4-[2-(2-methyl-1,3-thiazol-4-yl)ethylamino]cyclohexyl]methyl]pyrimidin-4-yl]methylidene]-1,3-thiazolidine-2,4-dione;(5Z)-5-[[2-[[4-(2-quinoxalin-6-ylethylamino)cyclohexyl]methyl]pyrimidin-4-yl]methylidene]-1,3-thiazolidine-2,4-dione;(5Z)-5-[[2-[[4-[2-([1,2,4]triazolo[1,5-a]pyrimidin-5-yl)ethylamino]cyclohexyl]methyl]pyrimidin-4-yl]methylidene]-1,3-thiazolidine-2,4-dione.

Molecular Properties

• Compound Name: (5Z)-5-[[2-[[4-[[4-fluoro-2-(furan-3-yl)phenyl]methylamino]cyclohexyl]methyl]pyrimidin-4-yl]methylidene]-1,3-thiazolidine-2,4-dione;(5Z)-5-[[2-[[4-[(4-fluoro-2-pyridin-3-ylphenyl)methylamino]cyclohexyl]methyl]pyrimidin-4-yl]methylidene]-1,3-thiazolidine-2,4-dione;(5Z)-5-[[2-[[4-[2-(1H-indol-2-yl)ethylamino]cyclohexyl]methyl]pyrimidin-4-yl]methylidene]-1,3-thiazolidine-2,4-dione;(5Z)-5-[[2-[[4-[2-(4-isocyanophenyl)ethylamino]cyclohexyl]methyl]pyrimidin-4-yl]methylidene]-1,3-thiazolidine-2,4-dione;(5Z)-5-[[2-[[4-[2-(5-methyl-2-phenyl-1,3-oxazol-4-yl)ethylamino]cyclohexyl]methyl]pyrimidin-4-yl]methylidene]-1,3-thiazolidine-2,4-dione;(5Z)-5-[[2-[[4-[2-(2-methyl-1,3-thiazol-4-yl)ethylamino]cyclohexyl]methyl]pyrimidin-4-yl]methylidene]-1,3-thiazolidine-2,4-dione;(5Z)-5-[[2-[[4-(2-quinoxalin-6-ylethylamino)cyclohexyl]methyl]pyrimidin-4-yl]methylidene]-1,3-thiazolidine-2,4-dione;(5Z)-5-[[2-[[4-[2-([1,2,4]triazolo[1,5-a]pyrimidin-5-yl)ethylamino]cyclohexyl]methyl]pyrimidin-4-yl]methylidene]-1,3-thiazolidine-2,4-dione
• PubChem CID: 157240058
• Molecular Formula: C197H207F2N43O18S9
• Molecular Weight: 3791.70 g/mol
• Exact Mass: 3788.41
• IUPAC Name: (5Z)-5-[[2-[[4-[[4-fluoro-2-(furan-3-yl)phenyl]methylamino]cyclohexyl]methyl]pyrimidin-4-yl]methylidene]-1,3-thiazolidine-2,4-dione;(5Z)-5-[[2-[[4-[(4-fluoro-2-pyridin-3-ylphenyl)methylamino]cyclohexyl]methyl]pyrimidin-4-yl]methylidene]-1,3-thiazolidine-2,4-dione;(5Z)-5-[[2-[[4-[2-(1H-indol-2-yl)ethylamino]cyclohexyl]methyl]pyrimidin-4-yl]methylidene]-1,3-thiazolidine-2,4-dione;(5Z)-5-[[2-[[4-[2-(4-isocyanophenyl)ethylamino]cyclohexyl]methyl]pyrimidin-4-yl]methylidene]-1,3-thiazolidine-2,4-dione;(5Z)-5-[[2-[[4-[2-(5-methyl-2-phenyl-1,3-oxazol-4-yl)ethylamino]cyclohexyl]methyl]pyrimidin-4-yl]methylidene]-1,3-thiazolidine-2,4-dione;(5Z)-5-[[2-[[4-[2-(2-methyl-1,3-thiazol-4-yl)ethylamino]cyclohexyl]methyl]pyrimidin-4-yl]methylidene]-1,3-thiazolidine-2,4-dione;(5Z)-5-[[2-[[4-(2-quinoxalin-6-ylethylamino)cyclohexyl]methyl]pyrimidin-4-yl]methylidene]-1,3-thiazolidine-2,4-dione;(5Z)-5-[[2-[[4-[2-([1,2,4]triazolo[1,5-a]pyrimidin-5-yl)ethylamino]cyclohexyl]methyl]pyrimidin-4-yl]methylidene]-1,3-thiazolidine-2,4-dione
• SMILES: Cc1nc(CCNC2CCC(Cc3nccc(/C=C4\SC(=O)NC4=O)n3)CC2)cs1.Cc1oc(-c2ccccc2)nc1CCNC1CCC(Cc2nccc(/C=C3\SC(=O)NC3=O)n2)CC1.O=C1NC(=O)/C(=C/c2ccnc(CC3CCC(NCCc4cc5ccccc5[nH]4)CC3)n2)S1.O=C1NC(=O)/C(=C/c2ccnc(CC3CCC(NCCc4ccc5nccnc5c4)CC3)n2)S1.O=C1NC(=O)/C(=C/c2ccnc(CC3CCC(NCCc4ccn5ncnc5n4)CC3)n2)S1.O=C1NC(=O)/C(=C/c2ccnc(CC3CCC(NCc4ccc(F)cc4-c4cccnc4)CC3)n2)S1.O=C1NC(=O)/C(=C/c2ccnc(CC3CCC(NCc4ccc(F)cc4-c4ccoc4)CC3)n2)S1.[C-]#[N+]c1ccc(CCNC2CCC(Cc3nccc(/C=C4\SC(=O)NC4=O)n3)CC2)cc1
• InChI: InChI=1S/C27H26FN5O2S.C27H29N5O3S.C26H25FN4O3S.C25H26N6O2S.C25H27N5O2S.C24H25N5O2S.C22H24N8O2S.C21H25N5O2S2/c28-20-6-5-19(23(13-20)18-2-1-10-29-15-18)16-31-21-7-3-17(4-8-21)12-25-30-11-9-22(32-25)14-24-26(34)33-27(35)36-24;1-17-22(31-26(35-17)19-5-3-2-4-6-19)12-14-28-20-9-7-18(8-10-20)15-24-29-13-11-21(30-24)16-23-25(33)32-27(34)36-23;27-19-4-3-17(22(12-19)18-8-10-34-15-18)14-29-20-5-1-16(2-6-20)11-24-28-9-7-21(30-24)13-23-25(32)31-26(33)35-23;32-24-22(34-25(33)31-24)15-19-8-10-29-23(30-19)14-16-1-4-18(5-2-16)26-9-7-17-3-6-20-21(13-17)28-12-11-27-20;31-24-22(33-25(32)30-24)15-20-10-12-27-23(29-20)13-16-5-7-18(8-6-16)26-11-9-19-14-17-3-1-2-4-21(17)28-19;1-25-18-6-2-16(3-7-18)10-12-26-19-8-4-17(5-9-19)14-22-27-13-11-20(28-22)15-21-23(30)29-24(31)32-21;31-20-18(33-22(32)29-20)12-17-6-9-24-19(27-17)11-14-1-3-15(4-2-14)23-8-5-16-7-10-30-21(28-16)25-13-26-30;1-13-24-17(12-29-13)7-8-22-15-4-2-14(3-5-15)10-19-23-9-6-16(25-19)11-18-20(27)26-21(28)30-18/h1-2,5-6,9-11,13-15,17,21,31H,3-4,7-8,12,16H2,(H,33,34,35);2-6,11,13,16,18,20,28H,7-10,12,14-15H2,1H3,(H,32,33,34);3-4,7-10,12-13,15-16,20,29H,1-2,5-6,11,14H2,(H,31,32,33);3,6,8,10-13,15-16,18,26H,1-2,4-5,7,9,14H2,(H,31,32,33);1-4,10,12,14-16,18,26,28H,5-9,11,13H2,(H,30,31,32);2-3,6-7,11,13,15,17,19,26H,4-5,8-10,12,14H2,(H,29,30,31);6-7,9-10,12-15,23H,1-5,8,11H2,(H,29,31,32);6,9,11-12,14-15,22H,2-5,7-8,10H2,1H3,(H,26,27,28)/b24-14-;23-16-;23-13-;2*22-15-;21-15-;18-12-;18-11-
• InChIKey: AVCISUSJCWPGTR-PIGIILFQSA-N
• XLogP: 32.53
• TPSA: 825.80 Ų
• H-Bond Donors: 17
• H-Bond Acceptors: 60
• Rotatable Bonds: 57
• Heavy Atoms: 269
• Complexity: —

Lipinski Rule of Five

4 violations

Rule	Value
MW ≤ 500	3791.70
LogP ≤ 5	32.53
H-Bond Donors ≤ 5	17
H-Bond Acceptors ≤ 10	60

Computed Properties (RDKit)

• Structural Alerts: {'alert_name': 'Carbo_cation/anion', 'substructure': 'N/A'}, {'alert_name': 'Michael_acceptor_1', 'substructure': 'N/A'}, {'alert_name': 'thioester', 'substructure': 'N/A'}

Frequently Asked Questions

What is the IUPAC name of (5Z)-5-[[2-[[4-[[4-fluoro-2-(furan-3-yl)phenyl]methylamino]cyclohexyl]methyl]pyrimidin-4-yl]methylidene]-1,3-thiazolidine-2,4-dione;(5Z)-5-[[2-[[4-[(4-fluoro-2-pyridin-3-ylphenyl)methylamino]cyclohexyl]methyl]pyrimidin-4-yl]methylidene]-1,3-thiazolidine-2,4-dione;(5Z)-5-[[2-[[4-[2-(1H-indol-2-yl)ethylamino]cyclohexyl]methyl]pyrimidin-4-yl]methylidene]-1,3-thiazolidine-2,4-dione;(5Z)-5-[[2-[[4-[2-(4-isocyanophenyl)ethylamino]cyclohexyl]methyl]pyrimidin-4-yl]methylidene]-1,3-thiazolidine-2,4-dione;(5Z)-5-[[2-[[4-[2-(5-methyl-2-phenyl-1,3-oxazol-4-yl)ethylamino]cyclohexyl]methyl]pyrimidin-4-yl]methylidene]-1,3-thiazolidine-2,4-dione;(5Z)-5-[[2-[[4-[2-(2-methyl-1,3-thiazol-4-yl)ethylamino]cyclohexyl]methyl]pyrimidin-4-yl]methylidene]-1,3-thiazolidine-2,4-dione;(5Z)-5-[[2-[[4-(2-quinoxalin-6-ylethylamino)cyclohexyl]methyl]pyrimidin-4-yl]methylidene]-1,3-thiazolidine-2,4-dione;(5Z)-5-[[2-[[4-[2-([1,2,4]triazolo[1,5-a]pyrimidin-5-yl)ethylamino]cyclohexyl]methyl]pyrimidin-4-yl]methylidene]-1,3-thiazolidine-2,4-dione?

The IUPAC name of (5Z)-5-[[2-[[4-[[4-fluoro-2-(furan-3-yl)phenyl]methylamino]cyclohexyl]methyl]pyrimidin-4-yl]methylidene]-1,3-thiazolidine-2,4-dione;(5Z)-5-[[2-[[4-[(4-fluoro-2-pyridin-3-ylphenyl)methylamino]cyclohexyl]methyl]pyrimidin-4-yl]methylidene]-1,3-thiazolidine-2,4-dione;(5Z)-5-[[2-[[4-[2-(1H-indol-2-yl)ethylamino]cyclohexyl]methyl]pyrimidin-4-yl]methylidene]-1,3-thiazolidine-2,4-dione;(5Z)-5-[[2-[[4-[2-(4-isocyanophenyl)ethylamino]cyclohexyl]methyl]pyrimidin-4-yl]methylidene]-1,3-thiazolidine-2,4-dione;(5Z)-5-[[2-[[4-[2-(5-methyl-2-phenyl-1,3-oxazol-4-yl)ethylamino]cyclohexyl]methyl]pyrimidin-4-yl]methylidene]-1,3-thiazolidine-2,4-dione;(5Z)-5-[[2-[[4-[2-(2-methyl-1,3-thiazol-4-yl)ethylamino]cyclohexyl]methyl]pyrimidin-4-yl]methylidene]-1,3-thiazolidine-2,4-dione;(5Z)-5-[[2-[[4-(2-quinoxalin-6-ylethylamino)cyclohexyl]methyl]pyrimidin-4-yl]methylidene]-1,3-thiazolidine-2,4-dione;(5Z)-5-[[2-[[4-[2-([1,2,4]triazolo[1,5-a]pyrimidin-5-yl)ethylamino]cyclohexyl]methyl]pyrimidin-4-yl]methylidene]-1,3-thiazolidine-2,4-dione (CID 157240058) is (5Z)-5-[[2-[[4-[[4-fluoro-2-(furan-3-yl)phenyl]methylamino]cyclohexyl]methyl]pyrimidin-4-yl]methylidene]-1,3-thiazolidine-2,4-dione;(5Z)-5-[[2-[[4-[(4-fluoro-2-pyridin-3-ylphenyl)methylamino]cyclohexyl]methyl]pyrimidin-4-yl]methylidene]-1,3-thiazolidine-2,4-dione;(5Z)-5-[[2-[[4-[2-(1H-indol-2-yl)ethylamino]cyclohexyl]methyl]pyrimidin-4-yl]methylidene]-1,3-thiazolidine-2,4-dione;(5Z)-5-[[2-[[4-[2-(4-isocyanophenyl)ethylamino]cyclohexyl]methyl]pyrimidin-4-yl]methylidene]-1,3-thiazolidine-2,4-dione;(5Z)-5-[[2-[[4-[2-(5-methyl-2-phenyl-1,3-oxazol-4-yl)ethylamino]cyclohexyl]methyl]pyrimidin-4-yl]methylidene]-1,3-thiazolidine-2,4-dione;(5Z)-5-[[2-[[4-[2-(2-methyl-1,3-thiazol-4-yl)ethylamino]cyclohexyl]methyl]pyrimidin-4-yl]methylidene]-1,3-thiazolidine-2,4-dione;(5Z)-5-[[2-[[4-(2-quinoxalin-6-ylethylamino)cyclohexyl]methyl]pyrimidin-4-yl]methylidene]-1,3-thiazolidine-2,4-dione;(5Z)-5-[[2-[[4-[2-([1,2,4]triazolo[1,5-a]pyrimidin-5-yl)ethylamino]cyclohexyl]methyl]pyrimidin-4-yl]methylidene]-1,3-thiazolidine-2,4-dione.

What is the SMILES notation for (5Z)-5-[[2-[[4-[[4-fluoro-2-(furan-3-yl)phenyl]methylamino]cyclohexyl]methyl]pyrimidin-4-yl]methylidene]-1,3-thiazolidine-2,4-dione;(5Z)-5-[[2-[[4-[(4-fluoro-2-pyridin-3-ylphenyl)methylamino]cyclohexyl]methyl]pyrimidin-4-yl]methylidene]-1,3-thiazolidine-2,4-dione;(5Z)-5-[[2-[[4-[2-(1H-indol-2-yl)ethylamino]cyclohexyl]methyl]pyrimidin-4-yl]methylidene]-1,3-thiazolidine-2,4-dione;(5Z)-5-[[2-[[4-[2-(4-isocyanophenyl)ethylamino]cyclohexyl]methyl]pyrimidin-4-yl]methylidene]-1,3-thiazolidine-2,4-dione;(5Z)-5-[[2-[[4-[2-(5-methyl-2-phenyl-1,3-oxazol-4-yl)ethylamino]cyclohexyl]methyl]pyrimidin-4-yl]methylidene]-1,3-thiazolidine-2,4-dione;(5Z)-5-[[2-[[4-[2-(2-methyl-1,3-thiazol-4-yl)ethylamino]cyclohexyl]methyl]pyrimidin-4-yl]methylidene]-1,3-thiazolidine-2,4-dione;(5Z)-5-[[2-[[4-(2-quinoxalin-6-ylethylamino)cyclohexyl]methyl]pyrimidin-4-yl]methylidene]-1,3-thiazolidine-2,4-dione;(5Z)-5-[[2-[[4-[2-([1,2,4]triazolo[1,5-a]pyrimidin-5-yl)ethylamino]cyclohexyl]methyl]pyrimidin-4-yl]methylidene]-1,3-thiazolidine-2,4-dione?

The canonical SMILES for (5Z)-5-[[2-[[4-[[4-fluoro-2-(furan-3-yl)phenyl]methylamino]cyclohexyl]methyl]pyrimidin-4-yl]methylidene]-1,3-thiazolidine-2,4-dione;(5Z)-5-[[2-[[4-[(4-fluoro-2-pyridin-3-ylphenyl)methylamino]cyclohexyl]methyl]pyrimidin-4-yl]methylidene]-1,3-thiazolidine-2,4-dione;(5Z)-5-[[2-[[4-[2-(1H-indol-2-yl)ethylamino]cyclohexyl]methyl]pyrimidin-4-yl]methylidene]-1,3-thiazolidine-2,4-dione;(5Z)-5-[[2-[[4-[2-(4-isocyanophenyl)ethylamino]cyclohexyl]methyl]pyrimidin-4-yl]methylidene]-1,3-thiazolidine-2,4-dione;(5Z)-5-[[2-[[4-[2-(5-methyl-2-phenyl-1,3-oxazol-4-yl)ethylamino]cyclohexyl]methyl]pyrimidin-4-yl]methylidene]-1,3-thiazolidine-2,4-dione;(5Z)-5-[[2-[[4-[2-(2-methyl-1,3-thiazol-4-yl)ethylamino]cyclohexyl]methyl]pyrimidin-4-yl]methylidene]-1,3-thiazolidine-2,4-dione;(5Z)-5-[[2-[[4-(2-quinoxalin-6-ylethylamino)cyclohexyl]methyl]pyrimidin-4-yl]methylidene]-1,3-thiazolidine-2,4-dione;(5Z)-5-[[2-[[4-[2-([1,2,4]triazolo[1,5-a]pyrimidin-5-yl)ethylamino]cyclohexyl]methyl]pyrimidin-4-yl]methylidene]-1,3-thiazolidine-2,4-dione is Cc1nc(CCNC2CCC(Cc3nccc(/C=C4\SC(=O)NC4=O)n3)CC2)cs1.Cc1oc(-c2ccccc2)nc1CCNC1CCC(Cc2nccc(/C=C3\SC(=O)NC3=O)n2)CC1.O=C1NC(=O)/C(=C/c2ccnc(CC3CCC(NCCc4cc5ccccc5[nH]4)CC3)n2)S1.O=C1NC(=O)/C(=C/c2ccnc(CC3CCC(NCCc4ccc5nccnc5c4)CC3)n2)S1.O=C1NC(=O)/C(=C/c2ccnc(CC3CCC(NCCc4ccn5ncnc5n4)CC3)n2)S1.O=C1NC(=O)/C(=C/c2ccnc(CC3CCC(NCc4ccc(F)cc4-c4cccnc4)CC3)n2)S1.O=C1NC(=O)/C(=C/c2ccnc(CC3CCC(NCc4ccc(F)cc4-c4ccoc4)CC3)n2)S1.[C-]#[N+]c1ccc(CCNC2CCC(Cc3nccc(/C=C4\SC(=O)NC4=O)n3)CC2)cc1.

What is the InChIKey of (5Z)-5-[[2-[[4-[[4-fluoro-2-(furan-3-yl)phenyl]methylamino]cyclohexyl]methyl]pyrimidin-4-yl]methylidene]-1,3-thiazolidine-2,4-dione;(5Z)-5-[[2-[[4-[(4-fluoro-2-pyridin-3-ylphenyl)methylamino]cyclohexyl]methyl]pyrimidin-4-yl]methylidene]-1,3-thiazolidine-2,4-dione;(5Z)-5-[[2-[[4-[2-(1H-indol-2-yl)ethylamino]cyclohexyl]methyl]pyrimidin-4-yl]methylidene]-1,3-thiazolidine-2,4-dione;(5Z)-5-[[2-[[4-[2-(4-isocyanophenyl)ethylamino]cyclohexyl]methyl]pyrimidin-4-yl]methylidene]-1,3-thiazolidine-2,4-dione;(5Z)-5-[[2-[[4-[2-(5-methyl-2-phenyl-1,3-oxazol-4-yl)ethylamino]cyclohexyl]methyl]pyrimidin-4-yl]methylidene]-1,3-thiazolidine-2,4-dione;(5Z)-5-[[2-[[4-[2-(2-methyl-1,3-thiazol-4-yl)ethylamino]cyclohexyl]methyl]pyrimidin-4-yl]methylidene]-1,3-thiazolidine-2,4-dione;(5Z)-5-[[2-[[4-(2-quinoxalin-6-ylethylamino)cyclohexyl]methyl]pyrimidin-4-yl]methylidene]-1,3-thiazolidine-2,4-dione;(5Z)-5-[[2-[[4-[2-([1,2,4]triazolo[1,5-a]pyrimidin-5-yl)ethylamino]cyclohexyl]methyl]pyrimidin-4-yl]methylidene]-1,3-thiazolidine-2,4-dione?

The InChIKey is AVCISUSJCWPGTR-PIGIILFQSA-N. The full InChI is InChI=1S/C27H26FN5O2S.C27H29N5O3S.C26H25FN4O3S.C25H26N6O2S.C25H27N5O2S.C24H25N5O2S.C22H24N8O2S.C21H25N5O2S2/c28-20-6-5-19(23(13-20)18-2-1-10-29-15-18)16-31-21-7-3-17(4-8-21)12-25-30-11-9-22(32-25)14-24-26(34)33-27(35)36-24;1-17-22(31-26(35-17)19-5-3-2-4-6-19)12-14-28-20-9-7-18(8-10-20)15-24-29-13-11-21(30-24)16-23-25(33)32-27(34)36-23;27-19-4-3-17(22(12-19)18-8-10-34-15-18)14-29-20-5-1-16(2-6-20)11-24-28-9-7-21(30-24)13-23-25(32)31-26(33)35-23;32-24-22(34-25(33)31-24)15-19-8-10-29-23(30-19)14-16-1-4-18(5-2-16)26-9-7-17-3-6-20-21(13-17)28-12-11-27-20;31-24-22(33-25(32)30-24)15-20-10-12-27-23(29-20)13-16-5-7-18(8-6-16)26-11-9-19-14-17-3-1-2-4-21(17)28-19;1-25-18-6-2-16(3-7-18)10-12-26-19-8-4-17(5-9-19)14-22-27-13-11-20(28-22)15-21-23(30)29-24(31)32-21;31-20-18(33-22(32)29-20)12-17-6-9-24-19(27-17)11-14-1-3-15(4-2-14)23-8-5-16-7-10-30-21(28-16)25-13-26-30;1-13-24-17(12-29-13)7-8-22-15-4-2-14(3-5-15)10-19-23-9-6-16(25-19)11-18-20(27)26-21(28)30-18/h1-2,5-6,9-11,13-15,17,21,31H,3-4,7-8,12,16H2,(H,33,34,35);2-6,11,13,16,18,20,28H,7-10,12,14-15H2,1H3,(H,32,33,34);3-4,7-10,12-13,15-16,20,29H,1-2,5-6,11,14H2,(H,31,32,33);3,6,8,10-13,15-16,18,26H,1-2,4-5,7,9,14H2,(H,31,32,33);1-4,10,12,14-16,18,26,28H,5-9,11,13H2,(H,30,31,32);2-3,6-7,11,13,15,17,19,26H,4-5,8-10,12,14H2,(H,29,30,31);6-7,9-10,12-15,23H,1-5,8,11H2,(H,29,31,32);6,9,11-12,14-15,22H,2-5,7-8,10H2,1H3,(H,26,27,28)/b24-14-;23-16-;23-13-;2*22-15-;21-15-;18-12-;18-11-.

What are the key properties of (5Z)-5-[[2-[[4-[[4-fluoro-2-(furan-3-yl)phenyl]methylamino]cyclohexyl]methyl]pyrimidin-4-yl]methylidene]-1,3-thiazolidine-2,4-dione;(5Z)-5-[[2-[[4-[(4-fluoro-2-pyridin-3-ylphenyl)methylamino]cyclohexyl]methyl]pyrimidin-4-yl]methylidene]-1,3-thiazolidine-2,4-dione;(5Z)-5-[[2-[[4-[2-(1H-indol-2-yl)ethylamino]cyclohexyl]methyl]pyrimidin-4-yl]methylidene]-1,3-thiazolidine-2,4-dione;(5Z)-5-[[2-[[4-[2-(4-isocyanophenyl)ethylamino]cyclohexyl]methyl]pyrimidin-4-yl]methylidene]-1,3-thiazolidine-2,4-dione;(5Z)-5-[[2-[[4-[2-(5-methyl-2-phenyl-1,3-oxazol-4-yl)ethylamino]cyclohexyl]methyl]pyrimidin-4-yl]methylidene]-1,3-thiazolidine-2,4-dione;(5Z)-5-[[2-[[4-[2-(2-methyl-1,3-thiazol-4-yl)ethylamino]cyclohexyl]methyl]pyrimidin-4-yl]methylidene]-1,3-thiazolidine-2,4-dione;(5Z)-5-[[2-[[4-(2-quinoxalin-6-ylethylamino)cyclohexyl]methyl]pyrimidin-4-yl]methylidene]-1,3-thiazolidine-2,4-dione;(5Z)-5-[[2-[[4-[2-([1,2,4]triazolo[1,5-a]pyrimidin-5-yl)ethylamino]cyclohexyl]methyl]pyrimidin-4-yl]methylidene]-1,3-thiazolidine-2,4-dione?

(5Z)-5-[[2-[[4-[[4-fluoro-2-(furan-3-yl)phenyl]methylamino]cyclohexyl]methyl]pyrimidin-4-yl]methylidene]-1,3-thiazolidine-2,4-dione;(5Z)-5-[[2-[[4-[(4-fluoro-2-pyridin-3-ylphenyl)methylamino]cyclohexyl]methyl]pyrimidin-4-yl]methylidene]-1,3-thiazolidine-2,4-dione;(5Z)-5-[[2-[[4-[2-(1H-indol-2-yl)ethylamino]cyclohexyl]methyl]pyrimidin-4-yl]methylidene]-1,3-thiazolidine-2,4-dione;(5Z)-5-[[2-[[4-[2-(4-isocyanophenyl)ethylamino]cyclohexyl]methyl]pyrimidin-4-yl]methylidene]-1,3-thiazolidine-2,4-dione;(5Z)-5-[[2-[[4-[2-(5-methyl-2-phenyl-1,3-oxazol-4-yl)ethylamino]cyclohexyl]methyl]pyrimidin-4-yl]methylidene]-1,3-thiazolidine-2,4-dione;(5Z)-5-[[2-[[4-[2-(2-methyl-1,3-thiazol-4-yl)ethylamino]cyclohexyl]methyl]pyrimidin-4-yl]methylidene]-1,3-thiazolidine-2,4-dione;(5Z)-5-[[2-[[4-(2-quinoxalin-6-ylethylamino)cyclohexyl]methyl]pyrimidin-4-yl]methylidene]-1,3-thiazolidine-2,4-dione;(5Z)-5-[[2-[[4-[2-([1,2,4]triazolo[1,5-a]pyrimidin-5-yl)ethylamino]cyclohexyl]methyl]pyrimidin-4-yl]methylidene]-1,3-thiazolidine-2,4-dione has a molecular weight of 3791.70 g/mol, XLogP of 32.53, 57 rotatable bonds, 17 hydrogen bond donors, and 60 hydrogen bond acceptors.

Where does this data come from?

All data for (5Z)-5-[[2-[[4-[[4-fluoro-2-(furan-3-yl)phenyl]methylamino]cyclohexyl]methyl]pyrimidin-4-yl]methylidene]-1,3-thiazolidine-2,4-dione;(5Z)-5-[[2-[[4-[(4-fluoro-2-pyridin-3-ylphenyl)methylamino]cyclohexyl]methyl]pyrimidin-4-yl]methylidene]-1,3-thiazolidine-2,4-dione;(5Z)-5-[[2-[[4-[2-(1H-indol-2-yl)ethylamino]cyclohexyl]methyl]pyrimidin-4-yl]methylidene]-1,3-thiazolidine-2,4-dione;(5Z)-5-[[2-[[4-[2-(4-isocyanophenyl)ethylamino]cyclohexyl]methyl]pyrimidin-4-yl]methylidene]-1,3-thiazolidine-2,4-dione;(5Z)-5-[[2-[[4-[2-(5-methyl-2-phenyl-1,3-oxazol-4-yl)ethylamino]cyclohexyl]methyl]pyrimidin-4-yl]methylidene]-1,3-thiazolidine-2,4-dione;(5Z)-5-[[2-[[4-[2-(2-methyl-1,3-thiazol-4-yl)ethylamino]cyclohexyl]methyl]pyrimidin-4-yl]methylidene]-1,3-thiazolidine-2,4-dione;(5Z)-5-[[2-[[4-(2-quinoxalin-6-ylethylamino)cyclohexyl]methyl]pyrimidin-4-yl]methylidene]-1,3-thiazolidine-2,4-dione;(5Z)-5-[[2-[[4-[2-([1,2,4]triazolo[1,5-a]pyrimidin-5-yl)ethylamino]cyclohexyl]methyl]pyrimidin-4-yl]methylidene]-1,3-thiazolidine-2,4-dione is sourced from PubChem (CID 157240058), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).