1-[[7-[5-chloro-2-(5,5-dimethylpyrrolidin-3-yl)oxy-3-methylphenyl]thieno[3,2-b]pyridin-2-yl]methyl]pyrrolidine-2,5-dione;3-[[4-[5-chloro-2-[(1R,2S)-2-fluorocyclopentyl]oxy-3-methylphenyl]thieno[3,2-d]pyrimidin-6-yl]methyl]-1,3-oxazolidine-2,4-dione;3-[[4-[5-chloro-2-[(1R,2S)-2-fluorocyclopentyl]oxy-3-methylphenyl]thieno[3,2-d]pyrimidin-6-yl]methyl]-1,3-thiazolidine-2,4-dione;1-[[7-[5-chloro-2-[(3R,5S)-5-(1-fluoroethyl)pyrrolidin-3-yl]oxy-3-methylphenyl]thieno[3,2-b]pyridin-2-yl]methyl]pyrrolidine-2,5-dione;1-[[7-[5-chloro-3-methyl-2-[(1S,3S)-3-methylcyclopentyl]oxyphenyl]thieno[3,2-b]pyridin-2-yl]methyl]pyrrolidine-2,5-dione;1-[[7-[5-chloro-3-methyl-2-[(1R,3R)-3-methylcyclopentyl]oxyphenyl]thieno[3,2-b]pyridin-2-yl]methyl]pyrrolidine-2,5-dione;3-[[7-[2-[(1R,2S)-2-fluorocyclopentyl]oxy-3-methyl-5-(trifluoromethyl)phenyl]thieno[3,2-b]pyridin-2-yl]methyl]-3-azabicyclo[3.1.0]hexane-2,4-dione

C170H161Cl6F7N18O22S8 — CID 161067325

About 1-[[7-[5-chloro-2-(5,5-dimethylpyrrolidin-3-yl)oxy-3-methylphenyl]thieno[3,2-b]pyridin-2-yl]methyl]pyrrolidine-2,5-dione;3-[[4-[5-chloro-2-[(1R,2S)-2-fluorocyclopentyl]oxy-3-methylphenyl]thieno[3,2-d]pyrimidin-6-yl]methyl]-1,3-oxazolidine-2,4-dione;3-[[4-[5-chloro-2-[(1R,2S)-2-fluorocyclopentyl]oxy-3-methylphenyl]thieno[3,2-d]pyrimidin-6-yl]methyl]-1,3-thiazolidine-2,4-dione;1-[[7-[5-chloro-2-[(3R,5S)-5-(1-fluoroethyl)pyrrolidin-3-yl]oxy-3-methylphenyl]thieno[3,2-b]pyridin-2-yl]methyl]pyrrolidine-2,5-dione;1-[[7-[5-chloro-3-methyl-2-[(1S,3S)-3-methylcyclopentyl]oxyphenyl]thieno[3,2-b]pyridin-2-yl]methyl]pyrrolidine-2,5-dione;1-[[7-[5-chloro-3-methyl-2-[(1R,3R)-3-methylcyclopentyl]oxyphenyl]thieno[3,2-b]pyridin-2-yl]methyl]pyrrolidine-2,5-dione;3-[[7-[2-[(1R,2S)-2-fluorocyclopentyl]oxy-3-methyl-5-(trifluoromethyl)phenyl]thieno[3,2-b]pyridin-2-yl]methyl]-3-azabicyclo[3.1.0]hexane-2,4-dione

1-[[7-[5-chloro-2-(5,5-dimethylpyrrolidin-3-yl)oxy-3-methylphenyl]thieno[3,2-b]pyridin-2-yl]methyl]pyrrolidine-2,5-dione;3-[[4-[5-chloro-2-[(1R,2S)-2-fluorocyclopentyl]oxy-3-methylphenyl]thieno[3,2-d]pyrimidin-6-yl]methyl]-1,3-oxazolidine-2,4-dione;3-[[4-[5-chloro-2-[(1R,2S)-2-fluorocyclopentyl]oxy-3-methylphenyl]thieno[3,2-d]pyrimidin-6-yl]methyl]-1,3-thiazolidine-2,4-dione;1-[[7-[5-chloro-2-[(3R,5S)-5-(1-fluoroethyl)pyrrolidin-3-yl]oxy-3-methylphenyl]thieno[3,2-b]pyridin-2-yl]methyl]pyrrolidine-2,5-dione;1-[[7-[5-chloro-3-methyl-2-[(1S,3S)-3-methylcyclopentyl]oxyphenyl]thieno[3,2-b]pyridin-2-yl]methyl]pyrrolidine-2,5-dione;1-[[7-[5-chloro-3-methyl-2-[(1R,3R)-3-methylcyclopentyl]oxyphenyl]thieno[3,2-b]pyridin-2-yl]methyl]pyrrolidine-2,5-dione;3-[[7-[2-[(1R,2S)-2-fluorocyclopentyl]oxy-3-methyl-5-(trifluoromethyl)phenyl]thieno[3,2-b]pyridin-2-yl]methyl]-3-azabicyclo[3.1.0]hexane-2,4-dione (PubChem CID 161067325) has the molecular formula C170H161Cl6F7N18O22S8 and a molecular weight of 3410.50 g/mol. Its IUPAC name is 1-[[7-[5-chloro-2-(5,5-dimethylpyrrolidin-3-yl)oxy-3-methylphenyl]thieno[3,2-b]pyridin-2-yl]methyl]pyrrolidine-2,5-dione;3-[[4-[5-chloro-2-[(1R,2S)-2-fluorocyclopentyl]oxy-3-methylphenyl]thieno[3,2-d]pyrimidin-6-yl]methyl]-1,3-oxazolidine-2,4-dione;3-[[4-[5-chloro-2-[(1R,2S)-2-fluorocyclopentyl]oxy-3-methylphenyl]thieno[3,2-d]pyrimidin-6-yl]methyl]-1,3-thiazolidine-2,4-dione;1-[[7-[5-chloro-2-[(3R,5S)-5-(1-fluoroethyl)pyrrolidin-3-yl]oxy-3-methylphenyl]thieno[3,2-b]pyridin-2-yl]methyl]pyrrolidine-2,5-dione;1-[[7-[5-chloro-3-methyl-2-[(1S,3S)-3-methylcyclopentyl]oxyphenyl]thieno[3,2-b]pyridin-2-yl]methyl]pyrrolidine-2,5-dione;1-[[7-[5-chloro-3-methyl-2-[(1R,3R)-3-methylcyclopentyl]oxyphenyl]thieno[3,2-b]pyridin-2-yl]methyl]pyrrolidine-2,5-dione;3-[[7-[2-[(1R,2S)-2-fluorocyclopentyl]oxy-3-methyl-5-(trifluoromethyl)phenyl]thieno[3,2-b]pyridin-2-yl]methyl]-3-azabicyclo[3.1.0]hexane-2,4-dione.

Molecular Properties

• Compound Name: 1-[[7-[5-chloro-2-(5,5-dimethylpyrrolidin-3-yl)oxy-3-methylphenyl]thieno[3,2-b]pyridin-2-yl]methyl]pyrrolidine-2,5-dione;3-[[4-[5-chloro-2-[(1R,2S)-2-fluorocyclopentyl]oxy-3-methylphenyl]thieno[3,2-d]pyrimidin-6-yl]methyl]-1,3-oxazolidine-2,4-dione;3-[[4-[5-chloro-2-[(1R,2S)-2-fluorocyclopentyl]oxy-3-methylphenyl]thieno[3,2-d]pyrimidin-6-yl]methyl]-1,3-thiazolidine-2,4-dione;1-[[7-[5-chloro-2-[(3R,5S)-5-(1-fluoroethyl)pyrrolidin-3-yl]oxy-3-methylphenyl]thieno[3,2-b]pyridin-2-yl]methyl]pyrrolidine-2,5-dione;1-[[7-[5-chloro-3-methyl-2-[(1S,3S)-3-methylcyclopentyl]oxyphenyl]thieno[3,2-b]pyridin-2-yl]methyl]pyrrolidine-2,5-dione;1-[[7-[5-chloro-3-methyl-2-[(1R,3R)-3-methylcyclopentyl]oxyphenyl]thieno[3,2-b]pyridin-2-yl]methyl]pyrrolidine-2,5-dione;3-[[7-[2-[(1R,2S)-2-fluorocyclopentyl]oxy-3-methyl-5-(trifluoromethyl)phenyl]thieno[3,2-b]pyridin-2-yl]methyl]-3-azabicyclo[3.1.0]hexane-2,4-dione
• PubChem CID: 161067325
• Molecular Formula: C170H161Cl6F7N18O22S8
• Molecular Weight: 3410.50 g/mol
• Exact Mass: 3404.78
• IUPAC Name: 1-[[7-[5-chloro-2-(5,5-dimethylpyrrolidin-3-yl)oxy-3-methylphenyl]thieno[3,2-b]pyridin-2-yl]methyl]pyrrolidine-2,5-dione;3-[[4-[5-chloro-2-[(1R,2S)-2-fluorocyclopentyl]oxy-3-methylphenyl]thieno[3,2-d]pyrimidin-6-yl]methyl]-1,3-oxazolidine-2,4-dione;3-[[4-[5-chloro-2-[(1R,2S)-2-fluorocyclopentyl]oxy-3-methylphenyl]thieno[3,2-d]pyrimidin-6-yl]methyl]-1,3-thiazolidine-2,4-dione;1-[[7-[5-chloro-2-[(3R,5S)-5-(1-fluoroethyl)pyrrolidin-3-yl]oxy-3-methylphenyl]thieno[3,2-b]pyridin-2-yl]methyl]pyrrolidine-2,5-dione;1-[[7-[5-chloro-3-methyl-2-[(1S,3S)-3-methylcyclopentyl]oxyphenyl]thieno[3,2-b]pyridin-2-yl]methyl]pyrrolidine-2,5-dione;1-[[7-[5-chloro-3-methyl-2-[(1R,3R)-3-methylcyclopentyl]oxyphenyl]thieno[3,2-b]pyridin-2-yl]methyl]pyrrolidine-2,5-dione;3-[[7-[2-[(1R,2S)-2-fluorocyclopentyl]oxy-3-methyl-5-(trifluoromethyl)phenyl]thieno[3,2-b]pyridin-2-yl]methyl]-3-azabicyclo[3.1.0]hexane-2,4-dione
• SMILES: Cc1cc(C(F)(F)F)cc(-c2ccnc3cc(CN4C(=O)C5CC5C4=O)sc23)c1O[C@@H]1CCC[C@@H]1F.Cc1cc(Cl)cc(-c2ccnc3cc(CN4C(=O)CCC4=O)sc23)c1OC1CNC(C)(C)C1.Cc1cc(Cl)cc(-c2ccnc3cc(CN4C(=O)CCC4=O)sc23)c1O[C@@H]1CC[C@@H](C)C1.Cc1cc(Cl)cc(-c2ccnc3cc(CN4C(=O)CCC4=O)sc23)c1O[C@H]1CC[C@H](C)C1.Cc1cc(Cl)cc(-c2ccnc3cc(CN4C(=O)CCC4=O)sc23)c1O[C@H]1CN[C@H](C(C)F)C1.Cc1cc(Cl)cc(-c2ncnc3cc(CN4C(=O)COC4=O)sc23)c1O[C@@H]1CCC[C@@H]1F.Cc1cc(Cl)cc(-c2ncnc3cc(CN4C(=O)CSC4=O)sc23)c1O[C@@H]1CCC[C@@H]1F
• InChI: InChI=1S/C26H22F4N2O3S.C25H25ClFN3O3S.C25H26ClN3O3S.2C25H25ClN2O3S.C22H19ClFN3O4S.C22H19ClFN3O3S2/c1-12-7-13(26(28,29)30)8-16(22(12)35-21-4-2-3-19(21)27)15-5-6-31-20-9-14(36-23(15)20)11-32-24(33)17-10-18(17)25(32)34;1-13-7-15(26)8-19(24(13)33-16-9-20(14(2)27)29-11-16)18-5-6-28-21-10-17(34-25(18)21)12-30-22(31)3-4-23(30)32;1-14-8-15(26)9-19(23(14)32-16-11-25(2,3)28-12-16)18-6-7-27-20-10-17(33-24(18)20)13-29-21(30)4-5-22(29)31;2*1-14-3-4-17(9-14)31-24-15(2)10-16(26)11-20(24)19-7-8-27-21-12-18(32-25(19)21)13-28-22(29)5-6-23(28)30;1-11-5-12(23)6-14(20(11)31-17-4-2-3-15(17)24)19-21-16(25-10-26-19)7-13(32-21)8-27-18(28)9-30-22(27)29;1-11-5-12(23)6-14(20(11)30-17-4-2-3-15(17)24)19-21-16(25-10-26-19)7-13(32-21)8-27-18(28)9-31-22(27)29/h5-9,17-19,21H,2-4,10-11H2,1H3;5-8,10,14,16,20,29H,3-4,9,11-12H2,1-2H3;6-10,16,28H,4-5,11-13H2,1-3H3;2*7-8,10-12,14,17H,3-6,9,13H2,1-2H3;2*5-7,10,15,17H,2-4,8-9H2,1H3/t17?,18?,19-,21+;14?,16-,20+;;2*14-,17-;2*15-,17+/m01.1000/s1
• InChIKey: UEESVFQKHKHZRG-ISGRLPQSSA-N
• XLogP: 39.34
• TPSA: 475.57 Ų
• H-Bond Donors: 2
• H-Bond Acceptors: 41
• Rotatable Bonds: 36
• Heavy Atoms: 231
• Complexity: —

Lipinski Rule of Five

3 violations

Rule	Value
MW ≤ 500	3410.50
LogP ≤ 5	39.34
H-Bond Donors ≤ 5	2
H-Bond Acceptors ≤ 10	41

Computed Properties (RDKit)

• Structural Alerts: {'alert_name': 'phthalimide', 'substructure': 'N/A'}, {'alert_name': 'thioester', 'substructure': 'N/A'}

Frequently Asked Questions

What is the IUPAC name of 1-[[7-[5-chloro-2-(5,5-dimethylpyrrolidin-3-yl)oxy-3-methylphenyl]thieno[3,2-b]pyridin-2-yl]methyl]pyrrolidine-2,5-dione;3-[[4-[5-chloro-2-[(1R,2S)-2-fluorocyclopentyl]oxy-3-methylphenyl]thieno[3,2-d]pyrimidin-6-yl]methyl]-1,3-oxazolidine-2,4-dione;3-[[4-[5-chloro-2-[(1R,2S)-2-fluorocyclopentyl]oxy-3-methylphenyl]thieno[3,2-d]pyrimidin-6-yl]methyl]-1,3-thiazolidine-2,4-dione;1-[[7-[5-chloro-2-[(3R,5S)-5-(1-fluoroethyl)pyrrolidin-3-yl]oxy-3-methylphenyl]thieno[3,2-b]pyridin-2-yl]methyl]pyrrolidine-2,5-dione;1-[[7-[5-chloro-3-methyl-2-[(1S,3S)-3-methylcyclopentyl]oxyphenyl]thieno[3,2-b]pyridin-2-yl]methyl]pyrrolidine-2,5-dione;1-[[7-[5-chloro-3-methyl-2-[(1R,3R)-3-methylcyclopentyl]oxyphenyl]thieno[3,2-b]pyridin-2-yl]methyl]pyrrolidine-2,5-dione;3-[[7-[2-[(1R,2S)-2-fluorocyclopentyl]oxy-3-methyl-5-(trifluoromethyl)phenyl]thieno[3,2-b]pyridin-2-yl]methyl]-3-azabicyclo[3.1.0]hexane-2,4-dione?

The IUPAC name of 1-[[7-[5-chloro-2-(5,5-dimethylpyrrolidin-3-yl)oxy-3-methylphenyl]thieno[3,2-b]pyridin-2-yl]methyl]pyrrolidine-2,5-dione;3-[[4-[5-chloro-2-[(1R,2S)-2-fluorocyclopentyl]oxy-3-methylphenyl]thieno[3,2-d]pyrimidin-6-yl]methyl]-1,3-oxazolidine-2,4-dione;3-[[4-[5-chloro-2-[(1R,2S)-2-fluorocyclopentyl]oxy-3-methylphenyl]thieno[3,2-d]pyrimidin-6-yl]methyl]-1,3-thiazolidine-2,4-dione;1-[[7-[5-chloro-2-[(3R,5S)-5-(1-fluoroethyl)pyrrolidin-3-yl]oxy-3-methylphenyl]thieno[3,2-b]pyridin-2-yl]methyl]pyrrolidine-2,5-dione;1-[[7-[5-chloro-3-methyl-2-[(1S,3S)-3-methylcyclopentyl]oxyphenyl]thieno[3,2-b]pyridin-2-yl]methyl]pyrrolidine-2,5-dione;1-[[7-[5-chloro-3-methyl-2-[(1R,3R)-3-methylcyclopentyl]oxyphenyl]thieno[3,2-b]pyridin-2-yl]methyl]pyrrolidine-2,5-dione;3-[[7-[2-[(1R,2S)-2-fluorocyclopentyl]oxy-3-methyl-5-(trifluoromethyl)phenyl]thieno[3,2-b]pyridin-2-yl]methyl]-3-azabicyclo[3.1.0]hexane-2,4-dione (CID 161067325) is 1-[[7-[5-chloro-2-(5,5-dimethylpyrrolidin-3-yl)oxy-3-methylphenyl]thieno[3,2-b]pyridin-2-yl]methyl]pyrrolidine-2,5-dione;3-[[4-[5-chloro-2-[(1R,2S)-2-fluorocyclopentyl]oxy-3-methylphenyl]thieno[3,2-d]pyrimidin-6-yl]methyl]-1,3-oxazolidine-2,4-dione;3-[[4-[5-chloro-2-[(1R,2S)-2-fluorocyclopentyl]oxy-3-methylphenyl]thieno[3,2-d]pyrimidin-6-yl]methyl]-1,3-thiazolidine-2,4-dione;1-[[7-[5-chloro-2-[(3R,5S)-5-(1-fluoroethyl)pyrrolidin-3-yl]oxy-3-methylphenyl]thieno[3,2-b]pyridin-2-yl]methyl]pyrrolidine-2,5-dione;1-[[7-[5-chloro-3-methyl-2-[(1S,3S)-3-methylcyclopentyl]oxyphenyl]thieno[3,2-b]pyridin-2-yl]methyl]pyrrolidine-2,5-dione;1-[[7-[5-chloro-3-methyl-2-[(1R,3R)-3-methylcyclopentyl]oxyphenyl]thieno[3,2-b]pyridin-2-yl]methyl]pyrrolidine-2,5-dione;3-[[7-[2-[(1R,2S)-2-fluorocyclopentyl]oxy-3-methyl-5-(trifluoromethyl)phenyl]thieno[3,2-b]pyridin-2-yl]methyl]-3-azabicyclo[3.1.0]hexane-2,4-dione.

What is the SMILES notation for 1-[[7-[5-chloro-2-(5,5-dimethylpyrrolidin-3-yl)oxy-3-methylphenyl]thieno[3,2-b]pyridin-2-yl]methyl]pyrrolidine-2,5-dione;3-[[4-[5-chloro-2-[(1R,2S)-2-fluorocyclopentyl]oxy-3-methylphenyl]thieno[3,2-d]pyrimidin-6-yl]methyl]-1,3-oxazolidine-2,4-dione;3-[[4-[5-chloro-2-[(1R,2S)-2-fluorocyclopentyl]oxy-3-methylphenyl]thieno[3,2-d]pyrimidin-6-yl]methyl]-1,3-thiazolidine-2,4-dione;1-[[7-[5-chloro-2-[(3R,5S)-5-(1-fluoroethyl)pyrrolidin-3-yl]oxy-3-methylphenyl]thieno[3,2-b]pyridin-2-yl]methyl]pyrrolidine-2,5-dione;1-[[7-[5-chloro-3-methyl-2-[(1S,3S)-3-methylcyclopentyl]oxyphenyl]thieno[3,2-b]pyridin-2-yl]methyl]pyrrolidine-2,5-dione;1-[[7-[5-chloro-3-methyl-2-[(1R,3R)-3-methylcyclopentyl]oxyphenyl]thieno[3,2-b]pyridin-2-yl]methyl]pyrrolidine-2,5-dione;3-[[7-[2-[(1R,2S)-2-fluorocyclopentyl]oxy-3-methyl-5-(trifluoromethyl)phenyl]thieno[3,2-b]pyridin-2-yl]methyl]-3-azabicyclo[3.1.0]hexane-2,4-dione?

The canonical SMILES for 1-[[7-[5-chloro-2-(5,5-dimethylpyrrolidin-3-yl)oxy-3-methylphenyl]thieno[3,2-b]pyridin-2-yl]methyl]pyrrolidine-2,5-dione;3-[[4-[5-chloro-2-[(1R,2S)-2-fluorocyclopentyl]oxy-3-methylphenyl]thieno[3,2-d]pyrimidin-6-yl]methyl]-1,3-oxazolidine-2,4-dione;3-[[4-[5-chloro-2-[(1R,2S)-2-fluorocyclopentyl]oxy-3-methylphenyl]thieno[3,2-d]pyrimidin-6-yl]methyl]-1,3-thiazolidine-2,4-dione;1-[[7-[5-chloro-2-[(3R,5S)-5-(1-fluoroethyl)pyrrolidin-3-yl]oxy-3-methylphenyl]thieno[3,2-b]pyridin-2-yl]methyl]pyrrolidine-2,5-dione;1-[[7-[5-chloro-3-methyl-2-[(1S,3S)-3-methylcyclopentyl]oxyphenyl]thieno[3,2-b]pyridin-2-yl]methyl]pyrrolidine-2,5-dione;1-[[7-[5-chloro-3-methyl-2-[(1R,3R)-3-methylcyclopentyl]oxyphenyl]thieno[3,2-b]pyridin-2-yl]methyl]pyrrolidine-2,5-dione;3-[[7-[2-[(1R,2S)-2-fluorocyclopentyl]oxy-3-methyl-5-(trifluoromethyl)phenyl]thieno[3,2-b]pyridin-2-yl]methyl]-3-azabicyclo[3.1.0]hexane-2,4-dione is Cc1cc(C(F)(F)F)cc(-c2ccnc3cc(CN4C(=O)C5CC5C4=O)sc23)c1O[C@@H]1CCC[C@@H]1F.Cc1cc(Cl)cc(-c2ccnc3cc(CN4C(=O)CCC4=O)sc23)c1OC1CNC(C)(C)C1.Cc1cc(Cl)cc(-c2ccnc3cc(CN4C(=O)CCC4=O)sc23)c1O[C@@H]1CC[C@@H](C)C1.Cc1cc(Cl)cc(-c2ccnc3cc(CN4C(=O)CCC4=O)sc23)c1O[C@H]1CC[C@H](C)C1.Cc1cc(Cl)cc(-c2ccnc3cc(CN4C(=O)CCC4=O)sc23)c1O[C@H]1CN[C@H](C(C)F)C1.Cc1cc(Cl)cc(-c2ncnc3cc(CN4C(=O)COC4=O)sc23)c1O[C@@H]1CCC[C@@H]1F.Cc1cc(Cl)cc(-c2ncnc3cc(CN4C(=O)CSC4=O)sc23)c1O[C@@H]1CCC[C@@H]1F.

What is the InChIKey of 1-[[7-[5-chloro-2-(5,5-dimethylpyrrolidin-3-yl)oxy-3-methylphenyl]thieno[3,2-b]pyridin-2-yl]methyl]pyrrolidine-2,5-dione;3-[[4-[5-chloro-2-[(1R,2S)-2-fluorocyclopentyl]oxy-3-methylphenyl]thieno[3,2-d]pyrimidin-6-yl]methyl]-1,3-oxazolidine-2,4-dione;3-[[4-[5-chloro-2-[(1R,2S)-2-fluorocyclopentyl]oxy-3-methylphenyl]thieno[3,2-d]pyrimidin-6-yl]methyl]-1,3-thiazolidine-2,4-dione;1-[[7-[5-chloro-2-[(3R,5S)-5-(1-fluoroethyl)pyrrolidin-3-yl]oxy-3-methylphenyl]thieno[3,2-b]pyridin-2-yl]methyl]pyrrolidine-2,5-dione;1-[[7-[5-chloro-3-methyl-2-[(1S,3S)-3-methylcyclopentyl]oxyphenyl]thieno[3,2-b]pyridin-2-yl]methyl]pyrrolidine-2,5-dione;1-[[7-[5-chloro-3-methyl-2-[(1R,3R)-3-methylcyclopentyl]oxyphenyl]thieno[3,2-b]pyridin-2-yl]methyl]pyrrolidine-2,5-dione;3-[[7-[2-[(1R,2S)-2-fluorocyclopentyl]oxy-3-methyl-5-(trifluoromethyl)phenyl]thieno[3,2-b]pyridin-2-yl]methyl]-3-azabicyclo[3.1.0]hexane-2,4-dione?

The InChIKey is UEESVFQKHKHZRG-ISGRLPQSSA-N. The full InChI is InChI=1S/C26H22F4N2O3S.C25H25ClFN3O3S.C25H26ClN3O3S.2C25H25ClN2O3S.C22H19ClFN3O4S.C22H19ClFN3O3S2/c1-12-7-13(26(28,29)30)8-16(22(12)35-21-4-2-3-19(21)27)15-5-6-31-20-9-14(36-23(15)20)11-32-24(33)17-10-18(17)25(32)34;1-13-7-15(26)8-19(24(13)33-16-9-20(14(2)27)29-11-16)18-5-6-28-21-10-17(34-25(18)21)12-30-22(31)3-4-23(30)32;1-14-8-15(26)9-19(23(14)32-16-11-25(2,3)28-12-16)18-6-7-27-20-10-17(33-24(18)20)13-29-21(30)4-5-22(29)31;2*1-14-3-4-17(9-14)31-24-15(2)10-16(26)11-20(24)19-7-8-27-21-12-18(32-25(19)21)13-28-22(29)5-6-23(28)30;1-11-5-12(23)6-14(20(11)31-17-4-2-3-15(17)24)19-21-16(25-10-26-19)7-13(32-21)8-27-18(28)9-30-22(27)29;1-11-5-12(23)6-14(20(11)30-17-4-2-3-15(17)24)19-21-16(25-10-26-19)7-13(32-21)8-27-18(28)9-31-22(27)29/h5-9,17-19,21H,2-4,10-11H2,1H3;5-8,10,14,16,20,29H,3-4,9,11-12H2,1-2H3;6-10,16,28H,4-5,11-13H2,1-3H3;2*7-8,10-12,14,17H,3-6,9,13H2,1-2H3;2*5-7,10,15,17H,2-4,8-9H2,1H3/t17?,18?,19-,21+;14?,16-,20+;;2*14-,17-;2*15-,17+/m01.1000/s1.

What are the key properties of 1-[[7-[5-chloro-2-(5,5-dimethylpyrrolidin-3-yl)oxy-3-methylphenyl]thieno[3,2-b]pyridin-2-yl]methyl]pyrrolidine-2,5-dione;3-[[4-[5-chloro-2-[(1R,2S)-2-fluorocyclopentyl]oxy-3-methylphenyl]thieno[3,2-d]pyrimidin-6-yl]methyl]-1,3-oxazolidine-2,4-dione;3-[[4-[5-chloro-2-[(1R,2S)-2-fluorocyclopentyl]oxy-3-methylphenyl]thieno[3,2-d]pyrimidin-6-yl]methyl]-1,3-thiazolidine-2,4-dione;1-[[7-[5-chloro-2-[(3R,5S)-5-(1-fluoroethyl)pyrrolidin-3-yl]oxy-3-methylphenyl]thieno[3,2-b]pyridin-2-yl]methyl]pyrrolidine-2,5-dione;1-[[7-[5-chloro-3-methyl-2-[(1S,3S)-3-methylcyclopentyl]oxyphenyl]thieno[3,2-b]pyridin-2-yl]methyl]pyrrolidine-2,5-dione;1-[[7-[5-chloro-3-methyl-2-[(1R,3R)-3-methylcyclopentyl]oxyphenyl]thieno[3,2-b]pyridin-2-yl]methyl]pyrrolidine-2,5-dione;3-[[7-[2-[(1R,2S)-2-fluorocyclopentyl]oxy-3-methyl-5-(trifluoromethyl)phenyl]thieno[3,2-b]pyridin-2-yl]methyl]-3-azabicyclo[3.1.0]hexane-2,4-dione?

1-[[7-[5-chloro-2-(5,5-dimethylpyrrolidin-3-yl)oxy-3-methylphenyl]thieno[3,2-b]pyridin-2-yl]methyl]pyrrolidine-2,5-dione;3-[[4-[5-chloro-2-[(1R,2S)-2-fluorocyclopentyl]oxy-3-methylphenyl]thieno[3,2-d]pyrimidin-6-yl]methyl]-1,3-oxazolidine-2,4-dione;3-[[4-[5-chloro-2-[(1R,2S)-2-fluorocyclopentyl]oxy-3-methylphenyl]thieno[3,2-d]pyrimidin-6-yl]methyl]-1,3-thiazolidine-2,4-dione;1-[[7-[5-chloro-2-[(3R,5S)-5-(1-fluoroethyl)pyrrolidin-3-yl]oxy-3-methylphenyl]thieno[3,2-b]pyridin-2-yl]methyl]pyrrolidine-2,5-dione;1-[[7-[5-chloro-3-methyl-2-[(1S,3S)-3-methylcyclopentyl]oxyphenyl]thieno[3,2-b]pyridin-2-yl]methyl]pyrrolidine-2,5-dione;1-[[7-[5-chloro-3-methyl-2-[(1R,3R)-3-methylcyclopentyl]oxyphenyl]thieno[3,2-b]pyridin-2-yl]methyl]pyrrolidine-2,5-dione;3-[[7-[2-[(1R,2S)-2-fluorocyclopentyl]oxy-3-methyl-5-(trifluoromethyl)phenyl]thieno[3,2-b]pyridin-2-yl]methyl]-3-azabicyclo[3.1.0]hexane-2,4-dione has a molecular weight of 3410.50 g/mol, XLogP of 39.34, 36 rotatable bonds, 2 hydrogen bond donors, and 41 hydrogen bond acceptors.

Where does this data come from?

All data for 1-[[7-[5-chloro-2-(5,5-dimethylpyrrolidin-3-yl)oxy-3-methylphenyl]thieno[3,2-b]pyridin-2-yl]methyl]pyrrolidine-2,5-dione;3-[[4-[5-chloro-2-[(1R,2S)-2-fluorocyclopentyl]oxy-3-methylphenyl]thieno[3,2-d]pyrimidin-6-yl]methyl]-1,3-oxazolidine-2,4-dione;3-[[4-[5-chloro-2-[(1R,2S)-2-fluorocyclopentyl]oxy-3-methylphenyl]thieno[3,2-d]pyrimidin-6-yl]methyl]-1,3-thiazolidine-2,4-dione;1-[[7-[5-chloro-2-[(3R,5S)-5-(1-fluoroethyl)pyrrolidin-3-yl]oxy-3-methylphenyl]thieno[3,2-b]pyridin-2-yl]methyl]pyrrolidine-2,5-dione;1-[[7-[5-chloro-3-methyl-2-[(1S,3S)-3-methylcyclopentyl]oxyphenyl]thieno[3,2-b]pyridin-2-yl]methyl]pyrrolidine-2,5-dione;1-[[7-[5-chloro-3-methyl-2-[(1R,3R)-3-methylcyclopentyl]oxyphenyl]thieno[3,2-b]pyridin-2-yl]methyl]pyrrolidine-2,5-dione;3-[[7-[2-[(1R,2S)-2-fluorocyclopentyl]oxy-3-methyl-5-(trifluoromethyl)phenyl]thieno[3,2-b]pyridin-2-yl]methyl]-3-azabicyclo[3.1.0]hexane-2,4-dione is sourced from PubChem (CID 161067325), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).