J8-A34
IC5O AChE 0.094 +/- 0.003 microM
General
Type : Piperidine,Sulfur Compound,Sulfonamide,Quinoline,Derivative of Donepezil
Chemical_Nomenclature : (1R,2aR,8bR)-N-(2-(1-benzylpiperidin-4-yl)ethyl)-8-chloro-4-oxo-1,2,2a,3,4,8b-hexahydrocyclobuta[c]isoquinoline-1-sulfonamide
Canonical SMILES : [C]1=[C][C]=C(C2=C1C(=O)[N][C]3[C]2[C](C3)[S](=O)(=O)[N]CC[C]4CCN(CC4)CC5=[C][C]=[C][C]=[C]5)Cl
InChI : InChI=1S\/C25H30ClN3O3S\/c26-20-8-4-7-19-23(20)24-21(28-25(19)30)15-22(24)33(31,32)27-12-9-17-10-13-29(14-11-17)16-18-5-2-1-3-6-18\/h1-8,17,21-22,24,27H,9-16H2,(H,28,30)
InChIKey : ZQYWGJNAMZPUPH-UHFFFAOYSA-N
Other name(s) :
MW : 488.04
Formula : C25H30ClN3O3S
CAS_number :
PubChem :
UniChem : ZQYWGJNAMZPUPH-UHFFFAOYSA-N
IUPHAR :
Wikipedia :
Target
References (1)
| Title : Sulfur-fluoride exchange (SuFEx)-enabled lead discovery of AChE inhibitors by fragment linking strategies - Zhang_2023_Eur.J.Med.Chem_257_115502 |
| Author(s) : Zhang Z , Zhang SL , Wu C , Li HH , Zha L , Shi J , Liu X , Qin HL , Tang W |
| Ref : Eur Journal of Medicinal Chemistry , 257 :115502 , 2023 |
| Abstract : Zhang_2023_Eur.J.Med.Chem_257_115502 |
| ESTHER : Zhang_2023_Eur.J.Med.Chem_257_115502 |
| PubMedSearch : Zhang_2023_Eur.J.Med.Chem_257_115502 |
| PubMedID: 37224761 |