PXS-4728A

Investigational

Details

Stereochemistry	ACHIRAL
Molecular Formula	C15H21FN2O2.ClH
Molecular Weight	316.799
Optical Activity	NONE
Defined Stereocenters	0 / 0
E/Z Centers	1
Charge	0

SHOW SMILES / InChI

Structure Search

SMILES

Cl.CC(C)(C)NC(=O)C1=CC=C(OC\C(CN)=C\F)C=C1

InChI

InChIKey=AEMZEDNMNLIDSL-YGCVIUNWSA-N

InChI=1S/C15H21FN2O2.ClH/c1-15(2,3)18-14(19)12-4-6-13(7-5-12)20-10-11(8-16)9-17;/h4-8H,9-10,17H2,1-3H3,(H,18,19);1H/b11-8+;

HIDE SMILES / InChI

Molecular Formula	C15H21FN2O2
Molecular Weight	280.3378
Charge	0
Count

Stereochemistry	ACHIRAL
Additional Stereochemistry	No
Defined Stereocenters	0 / 0
E/Z Centers	1
Optical Activity	NONE

Molecular Formula	ClH
Molecular Weight	36.461
Charge	0
Count

Stereochemistry	ACHIRAL
Additional Stereochemistry	No
Defined Stereocenters	0 / 0
E/Z Centers	0
Optical Activity	NONE

Approval Year

Targets

Primary Target	Pharmacology	Condition	Potency
Membrane primary amine oxidase 2 Target ID: Q16853 Gene ID: 8639.0 Gene Symbol: AOC3 Target Organism: Homo sapiens (Human) Sources: https://www.ncbi.nlm.nih.gov/pubmed/25889951 \| https://www.ncbi.nlm.nih.gov/pubmed/27495192	Inhibitor 8504

Substance Class	Chemical Created by `admin` on `Mon Mar 31 23:30:09 GMT 2025` Edited by `admin` on `Mon Mar 31 23:30:09 GMT 2025`
Record UNII	6W2049SJPH
Record Status	`Validated (UNII)`
Record Version

Download

Name

Type

Language

PXS-4728A

Common Name

English

BI-1467335

Preferred Name

English

BENZAMIDE, 4-(((2E)-2-(AMINOMETHYL)-3-FLUORO-2-PROPEN-1-YL)OXY)-N-(1,1-DIMETHYLETHYL)-, HYDROCHLORIDE (1:1)

Systematic Name

English

Code System Code Type Description

PUBCHEM

71812246

Created by admin on Mon Mar 31 23:30:09 GMT 2025 , Edited by admin on Mon Mar 31 23:30:09 GMT 2025

PRIMARY

CAS

1478364-68-9

Created by admin on Mon Mar 31 23:30:09 GMT 2025 , Edited by admin on Mon Mar 31 23:30:09 GMT 2025

PRIMARY

SMS_ID

300000019553

Created by admin on Mon Mar 31 23:30:09 GMT 2025 , Edited by admin on Mon Mar 31 23:30:09 GMT 2025

PRIMARY

FDA UNII

6W2049SJPH

Created by admin on Mon Mar 31 23:30:09 GMT 2025 , Edited by admin on Mon Mar 31 23:30:09 GMT 2025

PRIMARY

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