SCHEMBL22462761

General

Type : PET probe, Trifluoro, Urea derivative, Azetidin

Chemical_Nomenclature : (4aR,8aS)-6-[3-[2-[2-fluoro-6-(trifluoromethyl)phenyl]ethyl]azetidine-1-carbonyl]-4,4a,5,7,8,8a-hexahydropyrido[4,3-b][1,4]oxazin-3-one

Canonical SMILES : C1CN(CC2C1OCC(=O)N2)C(=O)N3CC(C3)CCC4=C(C=CC=C4F)C(F)(F)F

InChI : InChI=1S\/C20H23F4N3O3\/c21-15-3-1-2-14(20(22,23)24)13(15)5-4-12-8-27(9-12)19(29)26-7-6-17-16(10-26)25-18(28)11-30-17\/h1-3,12,16-17H,4-11H2,(H,25,28)\/t16-,17+\/m1\/s1

InChIKey : JFVCHTHNSGAFJV-SJORKVTESA-N

Other name(s) : [11C]7


MW : 429.4

Formula : C20H23F4N3O3

CAS_number :

PubChem : 155141985

UniChem : JFVCHTHNSGAFJV-SJORKVTESA-N

Target

Families : SCHEMBL22462761 ligand of proteins in family
Monoglyceridelipase_lysophospholip

Protein :
human-MGLL mouse-MGLL

References (1)

Title : Multi-parameter optimization: Development of a morpholin-3-one derivative with an improved kinetic profile for imaging monoacylglycerol lipase in the brain - He_2022_Eur.J.Med.Chem_243_114750
Author(s) : He Y , Grether U , Taddio MF , Meier C , Keller C , Edelmann MR , Honer M , Huber S , Wittwer MB , Heer D , Richter H , Collin L , Hug MN , Hilbert M , Postmus AGJ , Stevens AF , van der Stelt M , Kramer SD , Schibli R , Mu L , Gobbi LC
Ref : Eur Journal of Medicinal Chemistry , 243 :114750 , 2022
Abstract :
PubMedSearch : He_2022_Eur.J.Med.Chem_243_114750
PubMedID: 36137365
Gene_locus related to this paper: human-MGLL , mouse-MGLL