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Bis(Uracilyl)Alkane-cpd3c

AChE IC50 2.78 +/- O.47 nM; BChE IC50 28.0 +/- 1.0 microM

General

Type : Uracil derivative, Cyanide

Chemical_Nomenclature : 1,5-{(3,6-Dimethyluracil-1-yl)-[3-(5-o-nitrilebenzyl(ethyl)amino)pentyl)-uracil-1-yl]}pentane

Canonical SMILES : N1(C(C=C(N(C1=O)CCCCN2C(N(C(C=C2)=O)CCCCCN(CC)CC3=C(C=CC=C3)C#N)=O)C)=O)C

InChI : InChI=1S\/C29H38N6O4\/c1-4-32(22-25-13-7-6-12-24(25)21-30)15-8-5-9-18-35-26(36)14-19-33(29(35)39)16-10-11-17-34-23(2)20-27(37)31(3)28(34)38\/h6-7,12-14,19-20H,4-5,8-11,15-18,22H2,1-3H3

InChIKey : PJEKMKIVYFJQCZ-UHFFFAOYSA-N

Other name(s) : compound 3c

MW : 534.657

Formula : C29H38N6O4

CAS_number :

PubChem :

UniChem : PJEKMKIVYFJQCZ-UHFFFAOYSA-N

Target

Families : Bis(Uracilyl)Alkane-cpd3c ligand of proteins in family
ACHE

Protein :
human-ACHE

References (1)

Title : Ionic and Non-Ionic Counterparts Based on Bis(Uracilyl)Alkane Moiety with Highest Selectivity Towards Acetylcholinesterase for Protection Against Organophosphate Poisoning and Treating Alzheimer's Disease - Zueva_2025_Int.J.Mol.Sci_26_3759
Author(s) : Zueva IV , Saifina LF , Gubaidullina LM , Shulaeva MM , Kharlamova AD , Lenina OA , Belyaev GP , Ziganshina AY , Gao S , Tang W , Semenov VE , Petrov KA
Ref : Int J Mol Sci , 26 :3759 , 2025
Abstract :
PubMedSearch : Zueva_2025_Int.J.Mol.Sci_26_3759
PubMedID: 40332440