K474
General
Type : Bispyridinium, tert-Butyl
Chemical_Nomenclature : 4-tert-butyl-1-[7-(4-tert-butylpyridin-1-ium-1-yl)heptyl]pyridin-1-ium\;dibromide
Canonical SMILES : CC(C)(C)C1=CC=[N+](C=C1)CCCCCCC[N+]2=CC=C(C=C2)C(C)(C)C.[Br-].[Br-]
InChI : InChI=1S\/C25H40N2.2BrH\/c1-24(2,3)22-12-18-26(19-13-22)16-10-8-7-9-11-17-27-20-14-23(15-21-27)25(4,5)6\;\;\/h12-15,18-21H,7-11,16-17H2,1-6H3\;2*1H\/q+2\;\;\/p-2
InChIKey : LUFRQKFYXQGNBC-UHFFFAOYSA-L
Other name(s) : CHEMBL1642976 || K-474 || CTK2E1305 || CHEMBL1739621 || BDBM50334302
MW : 528.41
Formula : C25H40Br2N2
CAS_number : 61369-01-5
PubChem :
UniChem : LUFRQKFYXQGNBC-UHFFFAOYSA-L
Target
Structure : No structure
Families : No family
References (3)
| Title : Development of small bisquaternary cholinesterase inhibitors as drugs for pre-treatment of nerve agent poisonings - Kuca_2018_Drug.Des.Devel.Ther_12_505 |
| Author(s) : Kuca K , Karasova JZ , Soukup O , Kassa J , Novotna E , Sepsova V , Horova A , Pejchal J , Hrabinova M , Vodakova E , Jun D , Nepovimova E , Valis M , Musilek K |
| Ref : Drug Des Devel Ther , 12 :505 , 2018 |
| Abstract : |
| PubMedSearch : Kuca_2018_Drug.Des.Devel.Ther_12_505 |
| PubMedID: 29563775 |
| Title : A comparison of the efficacy of newly developed reversible inhibitors of acetylcholinesterase with commonly used pyridostigmine as pharmacological pre-treatment of soman-poisoned mice - Kassa_2012_Basic.Clin.Pharmacol.Toxicol_110_322 |
| Author(s) : Kassa J , Musilek K , Koomlova M , Bajgar J |
| Ref : Basic Clin Pharmacol Toxicol , 110 :322 , 2012 |
| Abstract : |
| PubMedSearch : Kassa_2012_Basic.Clin.Pharmacol.Toxicol_110_322 |
| PubMedID: 21981462 |
| Title : Preparation, in vitro screening and molecular modelling of symmetrical 4-tert-butylpyridinium cholinesterase inhibitors--analogues of SAD-128 - Musilek_2011_Bioorg.Med.Chem.Lett_21_150 |
| Author(s) : Musilek K , Roder J , Komloova M , Holas O , Hrabinova M , Pohanka M , Dohnal V , Opletalova V , Kuca K , Jung YS |
| Ref : Bioorganic & Medicinal Chemistry Lett , 21 :150 , 2011 |
| Abstract : |
| PubMedSearch : Musilek_2011_Bioorg.Med.Chem.Lett_21_150 |
| PubMedID: 21144749 |