Levetiracetam-huprine-hybrid-Cpd10
hACHE IC50 4.2 nM; hBCHE 232 nM || hACHE IC50 4.2 nM; hBCHE 232 nM. Heptamethylene-linked levetiracetam-huprine hybrid potent inhibitor of human acetylcholinesterase and butyrylcholinesterase in vitro and moderately potent Abeta42 and tau antiaggregation
General
Type : Pyrrolidine, Multitarget, Derivative of Huperzine, Alkyl linked bis-ligand
Chemical_Nomenclature : (2S)-N-[7-[[(1S,13S)-7-chloro-15-methyl-10-azatetracyclo[11.3.1.02,11.04,9]heptadeca-2,4(9),5,7,10,14-hexaen-3-yl]amino]heptyl]-2-(2-oxopyrrolidin-1-yl)butanamide
Canonical SMILES : CC[C@@H](C(=O)NCCCCCCCNC1=C2[C@H]3C[C@@H](CC2=NC4=C1C=CC(=C4)Cl)C=C(C3)C)N5CCCC5=O
InChI : InChI=1S\/C32H43ClN4O2\/c1-3-28(37-15-9-10-29(37)38)32(39)35-14-8-6-4-5-7-13-34-31-25-12-11-24(33)20-26(25)36-27-19-22-16-21(2)17-23(18-22)30(27)31\/h11-12,16,20,22-23,28H,3-10,13-15,17-19H2,1-2H3,(H,34,36)(H,35,39)\/t22-,23+,28-\/m0\/s1
InChIKey : PTNOSDSMMDSVPV-JWZKTCGFSA-N
Other name(s) : Compound 10
MW : 551.2
Formula : C32H43ClN4O2
CAS_number :
PubChem : 86346175
UniChem : PTNOSDSMMDSVPV-JWZKTCGFSA-N
Target
Families : Levetiracetam-huprine-hybrid-Cpd10 ligand of proteins in family
ACHE
BCHE
Protein :
human-ACHE
human-BCHE
References (1)
| Title : Novel Levetiracetam Derivatives That Are Effective against the Alzheimer-like Phenotype in Mice: Synthesis, in Vitro, ex Vivo, and in Vivo Efficacy Studies - Sola_2015_J.Med.Chem_58_6018 |
| Author(s) : Sola I , Aso E , Frattini D , Lopez-Gonzalez I , Espargaro A , Sabate R , Di Pietro O , Luque FJ , Clos MV , Ferrer I , Munoz-Torrero D |
| Ref : Journal of Medicinal Chemistry , 58 :6018 , 2015 |
| Abstract : |
| PubMedSearch : Sola_2015_J.Med.Chem_58_6018 |
| PubMedID: 26181606 |