N-(3,3-diphenylpropyl)pyrrolidine-1-carboxamide

General

Type : Pyrrolidine, Carboxamide

Chemical_Nomenclature : N-(3,3-diphenylpropyl)pyrrole-1-carboxamide

Canonical SMILES : C1=CC=C(C=C1)C(CCNC(=O)N2C=CC=C2)C3=CC=CC=C3

InChI : InChI=1S\/C20H20N2O\/c23-20(22-15-7-8-16-22)21-14-13-19(17-9-3-1-4-10-17)18-11-5-2-6-12-18\/h1-12,15-16,19H,13-14H2,(H,21,23)

InChIKey : HEHFNRQOOMVVBY-UHFFFAOYSA-N

Other name(s) : Compound 4  ||  Q27456468  ||  6N8


MW : 304.4

Formula : C20H20N2O

CAS_number :

PubChem : 91754973

UniChem : HEHFNRQOOMVVBY-UHFFFAOYSA-N

Target

Families : N-(3,3-diphenylpropyl)pyrrolidine-1-carboxamide ligand of proteins in family
Epoxide_hydrolase

Structure :
8QVG 5AKL

Protein :
human-EPHX2

References (2)

Title : Exploring serial crystallography for drug discovery - Dunge_2024_IUCrJ__
Author(s) : Dunge A , Phan C , Uwangue O , Bjelcic M , Gunnarsson J , Wehlander G , Kack H , Branden G
Ref : IUCrJ , : , 2024
Abstract :
PubMedSearch : Dunge_2024_IUCrJ__
PubMedID: 39072424

Title : Successful generation of structural information for fragment-based drug discovery - Oster_2015_Drug.Discov.Today_20_1104
Author(s) : Oster L , Tapani S , Xue Y , Kack H
Ref : Drug Discov Today , 20 :1104 , 2015
Abstract :
PubMedSearch : Oster_2015_Drug.Discov.Today_20_1104
PubMedID: 25931264
Gene_locus related to this paper: human-EPHX2