beta-lactam-A296-1

General

Type : Piperazine, Azetidin, beta-Lactam

Chemical_Nomenclature : 1-[3-[[4-[(4-bromophenyl)methyl]piperazin-1-yl]methyl]phenyl]azetidin-2-one

Canonical SMILES : c1cc(cc(c1)N2CCC2=O)CN3CCN(CC3)Cc4ccc(cc4)Br

InChI : InChI=1S\/C21H24BrN3O\/c22-19-6-4-17(5-7-19)15-23-10-12-24(13-11-23)16-18-2-1-3-20(14-18)25-9-8-21(25)26\/h1-7,14H,8-13,15-16H2

InChIKey : UKZMZNGKMQQUCK-UHFFFAOYSA-N

Other name(s) : QX8


MW : 414.34

Formula : C21H24BrN3O

CAS_number :

PubChem : 155928367

UniChem : UKZMZNGKMQQUCK-UHFFFAOYSA-N

Target

Families : beta-lactam-A296-1 ligand of proteins in family
DPP4N_Peptidase_S9

Structure :
7A3K

Protein :
human-DPP8

References (1)

Title : Chemoproteomics-Enabled Identification of 4-Oxo-beta-Lactams as Inhibitors of Dipeptidyl Peptidases 8 and 9 - Carvalho_2022_Angew.Chem.Int.Ed.Engl_61_e202210498
Author(s) : Carvalho LAR , Ross B , Fehr L , Bolgi O , Wohrle S , Lum KM , Podlesainski D , Vieira AC , Kiefersauer R , Felix R , Rodrigues T , Lucas SD , Gross O , Geiss-Friedlander R , Cravatt BF , Huber R , Kaiser M , Moreira R
Ref : Angew Chem Int Ed Engl , : , 2022
Abstract :
PubMedSearch : Carvalho_2022_Angew.Chem.Int.Ed.Engl_61_e202210498
PubMedID: 36089535
Gene_locus related to this paper: human-DPP8 , human-DPP9