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Details

Stereochemistry ACHIRAL
Molecular Formula C9H9ClN2O3
Molecular Weight 228.632
Optical Activity NONE
Defined Stereocenters 0 / 0
E/Z Centers 0
Charge 0

SHOW SMILES / InChI
Structure of BENURESTAT

SMILES

ONC(=O)CNC(=O)C1=CC=C(Cl)C=C1

InChI

InChIKey=JFZGBMJPJZDNNT-UHFFFAOYSA-N
InChI=1S/C9H9ClN2O3/c10-7-3-1-6(2-4-7)9(14)11-5-8(13)12-15/h1-4,15H,5H2,(H,11,14)(H,12,13)

HIDE SMILES / InChI
Benurestat is a urease inhibitor, which as was shown in experiments on rats, could decrease in the urinary excretion of ammonia with experimental P. mirabilis genitourinary tract infection.

Approval Year

Targets

Targets

Primary TargetPharmacologyConditionPotency
Conditions

Conditions

ConditionModalityTargetsHighest PhaseProduct
PubMed

PubMed

TitleDatePubMed
Role of urease in the formation of infection stones: comparison of ureases from different sources.
1981 Apr

Sample Use Guides

in rats: benurestat administration, 25, 50, or 100 mg per kg, caused a decrease in the urinary excretion of ammonia from rats with experimental P. mirabilis genitourinary tract infection.
Route of Administration: Oral
In Vitro Use Guide
Urease activity was measured with a substrate concentration of 5 mg/ml using an ammonium-sensitive electrode, and expressed as micromoles of urea hydrolyzed per minute per milligram of protein. The concentrations of benurestat producing 50% inhibition of urease was determined directly, by adding the inhibitor solution to the substrate before the enzyme, and after preincubation (5 min) of enzyme with inhibitor before addition to the reaction vessel.
Name Type Language
BENURESTAT
INN   USAN  
INN   USAN  
Official Name English
BENZAMIDE, 4-CHLORO-N-(2-(HYDROXYAMINO)-2-OXOETHYL)-
Systematic Name English
BENURESTAT [USAN]
Common Name English
NSC-220913
Code English
EU-2826
Code English
2-(4-Chlorobenzamido)acetohydroxamic acid
Systematic Name English
benurestat [INN]
Common Name English
Classification Tree Code System Code
NCI_THESAURUS C471
Created by admin on Sat Dec 16 16:00:16 GMT 2023 , Edited by admin on Sat Dec 16 16:00:16 GMT 2023
Code System Code Type Description
MESH
C009851
Created by admin on Sat Dec 16 16:00:16 GMT 2023 , Edited by admin on Sat Dec 16 16:00:16 GMT 2023
PRIMARY
CAS
38274-54-3
Created by admin on Sat Dec 16 16:00:16 GMT 2023 , Edited by admin on Sat Dec 16 16:00:16 GMT 2023
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PUBCHEM
38000
Created by admin on Sat Dec 16 16:00:16 GMT 2023 , Edited by admin on Sat Dec 16 16:00:16 GMT 2023
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NCI_THESAURUS
C81697
Created by admin on Sat Dec 16 16:00:16 GMT 2023 , Edited by admin on Sat Dec 16 16:00:16 GMT 2023
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EPA CompTox
DTXSID70191656
Created by admin on Sat Dec 16 16:00:16 GMT 2023 , Edited by admin on Sat Dec 16 16:00:16 GMT 2023
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ChEMBL
CHEMBL2105796
Created by admin on Sat Dec 16 16:00:16 GMT 2023 , Edited by admin on Sat Dec 16 16:00:16 GMT 2023
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FDA UNII
9RA9A22Z0W
Created by admin on Sat Dec 16 16:00:16 GMT 2023 , Edited by admin on Sat Dec 16 16:00:16 GMT 2023
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INN
3568
Created by admin on Sat Dec 16 16:00:16 GMT 2023 , Edited by admin on Sat Dec 16 16:00:16 GMT 2023
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NSC
220913
Created by admin on Sat Dec 16 16:00:16 GMT 2023 , Edited by admin on Sat Dec 16 16:00:16 GMT 2023
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EVMPD
SUB05738MIG
Created by admin on Sat Dec 16 16:00:16 GMT 2023 , Edited by admin on Sat Dec 16 16:00:16 GMT 2023
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SMS_ID
100000086360
Created by admin on Sat Dec 16 16:00:16 GMT 2023 , Edited by admin on Sat Dec 16 16:00:16 GMT 2023
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