PROFEXALONE

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National Institutes of Health Divider Arrow

NCATS

Details

Stereochemistry	RACEMIC
Molecular Formula	C13H16N2O3
Molecular Weight	248.2777
Optical Activity	( + / - )
Defined Stereocenters	0 / 1
E/Z Centers	0
Charge	0

SHOW SMILES / InChI

Structure of PROFEXALONE

Structure Search

SMILES

CCCNC(=O)N1CC(OC1=O)C2=CC=CC=C2

InChI

InChIKey=AUVLZBKTWSCAIM-UHFFFAOYSA-N

InChI=1S/C13H16N2O3/c1-2-8-14-12(16)15-9-11(18-13(15)17)10-6-4-3-5-7-10/h3-7,11H,2,8-9H2,1H3,(H,14,16)

HIDE SMILES / InChI

Description
Sources: https://www.ncbi.nlm.nih.gov/pubmed/9879506 | https://worldwide.espacenet.com/publicationDetails/biblio?DB=EPODOC&II=0&ND=3&adjacent=true&locale=en_EP&FT=D&date=19711014&CC=DE&NR=2111775A1&KC=A1

Profexalone is an oxazolidinone derivative patented by Delalande S. A. as anticonvulsive, muscle-relaxant, antidepressive, anti-inflammatory, and analgesic compound.

Originator

Approval Year

PubMed

PubMed

Title	Date	PubMed
Designing sedative/hypnotic compounds from a novel substructural graph-theoretical approach.	1998 Nov	9879506

Patents

Patents

Name

Type

Language

PROFEXALONE

Official Name

English

3-OXAZOLIDINECARBOXAMIDE, 2-OXO-5-PHENYL-N-PROPYL-

Systematic Name

English

profexalone [INN]

Common Name

English

Classification Tree Code System Code

NCI_THESAURUS

C29756

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Code System Code Type Description

EVMPD

SUB10072MIG

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NCI_THESAURUS

C66475

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CAS

34740-13-1

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ChEMBL

CHEMBL2104609

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PUBCHEM

65786

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FDA UNII

3T29053XGS

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SMS_ID

100000081120

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INN

3634

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EPA CompTox

DTXSID70865729

Created by admin on Fri Dec 15 16:27:53 GMT 2023 , Edited by admin on Fri Dec 15 16:27:53 GMT 2023

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ECHA (EC/EINECS)

252-177-0

Created by admin on Fri Dec 15 16:27:53 GMT 2023 , Edited by admin on Fri Dec 15 16:27:53 GMT 2023

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ACTIVE MOIETY


					3T29053XGS