Diazepan-AJH

General

Type : Trifluoro,Diazepan,Azepane

Chemical_Nomenclature : 4-[4-[(3R)-3-amino-4-(2,4,5-trifluorophenyl)butanoyl]-1,4-diazepane-1-carbonyl]benzoic acid

Canonical SMILES : C1CN(CCN(C1)C(=O)C2=CC=C(C=C2)C(=O)O)C(=O)CC(CC3=CC(=C(C=C3F)F)F)N

InChI : InChI=1S\/C23H24F3N3O4\/c24-18-13-20(26)19(25)11-16(18)10-17(27)12-21(30)28-6-1-7-29(9-8-28)22(31)14-2-4-15(5-3-14)23(32)33\/h2-5,11,13,17H,1,6-10,12,27H2,(H,32,33)\/t17-\/m1\/s1

InChIKey : NXUBRAZWHJADLI-QGZVFWFLSA-N

Other name(s) : AJH,CHEMBL482154,CHEMBL1186902,BDBM50256569,(R)-4-(4-(3-amino-4-(2,4,5-trifluorophenyl)butanoyl)-1,4-diazepane-1-carbonyl)benzoic acid hydrochloride,4-({4-[(3r)-3-Amino-4-(2,4,5-Trifluorophenyl)butanoyl]-1,4-Diazepan-1-Yl}carbonyl)benzoic Acid


MW : 463.45

Formula : C23H24F3N3O4

CAS_number :

PubChem : 25021195

UniChem : NXUBRAZWHJADLI-QGZVFWFLSA-N

IUPHAR :

Wikipedia :

Target

Families : Diazepan-AJH ligand of proteins in family: DPP4N_Peptidase_S9

Stucture : 3EIO Crystal Structure Analysis of DPPIV Inhibitor

Protein : human-DPP4

References (2)

Title : Synthesis and biological evaluation of homopiperazine derivatives with beta-aminoacyl group as dipeptidyl peptidase IV inhibitors - Ahn_2008_Bioorg.Med.Chem.Lett_18_6525
Author(s) : Ahn JH , Park WS , Jun MA , Shin MS , Kang SK , Kim KY , Rhee SD , Bae MA , Kim KR , Kim SG , Kim SY , Sohn SK , Kang NS , Lee JO , Lee DH , Cheon HG , Kim SS
Ref : Bioorganic & Medicinal Chemistry Lett , 18 :6525 , 2008
Abstract : Ahn_2008_Bioorg.Med.Chem.Lett_18_6525
ESTHER : Ahn_2008_Bioorg.Med.Chem.Lett_18_6525
PubMedSearch : Ahn_2008_Bioorg.Med.Chem.Lett_18_6525
PubMedID: 18996694
Gene_locus related to this paper: human-DPP4

Title : Synthesis and biological evaluation of pyrazoline analogues with beta-amino acyl group as dipeptidyl peptidase IV inhibitors - Jun_2008_Eur.J.Med.Chem_43_1889
Author(s) : Jun MA , Park WS , Kang SK , Kim KY , Kim KR , Rhee SD , Bae MA , Kang NS , Sohn SK , Kim SG , Lee JO , Lee DH , Cheon HG , Kim SS , Ahn JH
Ref : Eur Journal of Medicinal Chemistry , 43 :1889 , 2008
Abstract : Jun_2008_Eur.J.Med.Chem_43_1889
ESTHER : Jun_2008_Eur.J.Med.Chem_43_1889
PubMedSearch : Jun_2008_Eur.J.Med.Chem_43_1889
PubMedID: 18243422
Gene_locus related to this paper: human-DPP4