U.S. Department of Health & Human Services Divider Arrow National Institutes of Health Divider Arrow NCATS

Details

Stereochemistry ACHIRAL
Molecular Formula C28H41ClN2O
Molecular Weight 457.091
Optical Activity NONE
Defined Stereocenters 0 / 0
E/Z Centers 0
Charge 0

SHOW SMILES / InChI
Structure of TEROXALENE

SMILES

CCC(C)(C)C1=CC=C(OCCCCCCN2CCN(CC2)C3=CC=C(C)C(Cl)=C3)C=C1

InChI

InChIKey=LRQIJOWDNRNLDY-UHFFFAOYSA-N
InChI=1S/C28H41ClN2O/c1-5-28(3,4)24-11-14-26(15-12-24)32-21-9-7-6-8-16-30-17-19-31(20-18-30)25-13-10-23(2)27(29)22-25/h10-15,22H,5-9,16-21H2,1-4H3

HIDE SMILES / InChI
Molecular Formula C28H41ClN2O
Molecular Weight 457.091
Charge 0
Count
Stereochemistry ACHIRAL
Additional Stereochemistry No
Defined Stereocenters 0 / 0
E/Z Centers 0
Optical Activity NONE

Description

Teroxalene is a dioxopiperazine derivative with multidrug resistance reversal activity

Originator

Michalsky, Jiri; Ctvrtnik, Josef
2
Sources: CS106503 "Derivatives of 2,​5-​dioxopiperazine" Feb 15, 1963

Approval Year

Unknown
149124
PubMed

PubMed

TitleDatePubMed
Reversal of multidrug resistance by bis(phenylalkyl)amines and structurally related compounds.
1994
Patents

Patents

20040058896
57
6331289
128
6680047
81
CS106503
2
WO2007061529A1
72
Substance Class Chemical
Created
by admin
on Mon Mar 31 19:09:57 GMT 2025
Edited
by admin
on Mon Mar 31 19:09:57 GMT 2025
Record UNII
R4ZID09918
Record Status Validated (UNII)
Record Version
  • Download
Name Type Language
1-(3-CHLORO-P-TOLYL)-4-(6-(P-TERT-PENTYLPHENOXY)HEXYL)PIPERAZINE
Preferred Name English
TEROXALENE
INN  
INN  
Official Name English
teroxalene [INN]
Common Name English
Classification Tree Code System Code
NCI_THESAURUS C250
Created by admin on Mon Mar 31 19:09:57 GMT 2025 , Edited by admin on Mon Mar 31 19:09:57 GMT 2025
Code System Code Type Description
EPA CompTox
DTXSID40163643
Created by admin on Mon Mar 31 19:09:57 GMT 2025 , Edited by admin on Mon Mar 31 19:09:57 GMT 2025
PRIMARY
PUBCHEM
19705
Created by admin on Mon Mar 31 19:09:57 GMT 2025 , Edited by admin on Mon Mar 31 19:09:57 GMT 2025
PRIMARY
FDA UNII
R4ZID09918
Created by admin on Mon Mar 31 19:09:57 GMT 2025 , Edited by admin on Mon Mar 31 19:09:57 GMT 2025
PRIMARY
INN
2170
Created by admin on Mon Mar 31 19:09:57 GMT 2025 , Edited by admin on Mon Mar 31 19:09:57 GMT 2025
PRIMARY
SMS_ID
100000082713
Created by admin on Mon Mar 31 19:09:57 GMT 2025 , Edited by admin on Mon Mar 31 19:09:57 GMT 2025
PRIMARY
NCI_THESAURUS
C152571
Created by admin on Mon Mar 31 19:09:57 GMT 2025 , Edited by admin on Mon Mar 31 19:09:57 GMT 2025
PRIMARY
ChEMBL
CHEMBL2111143
Created by admin on Mon Mar 31 19:09:57 GMT 2025 , Edited by admin on Mon Mar 31 19:09:57 GMT 2025
PRIMARY
CAS
14728-33-7
Created by admin on Mon Mar 31 19:09:57 GMT 2025 , Edited by admin on Mon Mar 31 19:09:57 GMT 2025
PRIMARY
EVMPD
SUB10931MIG
Created by admin on Mon Mar 31 19:09:57 GMT 2025 , Edited by admin on Mon Mar 31 19:09:57 GMT 2025
PRIMARY
Related Record Type Details
Structure of TEROXALENE HYDROCHLORIDE
SALT/SOLVATE -> PARENT
Related Record Type Details
Structure of TEROXALENE
ACTIVE MOIETY
NIH
NCATS
PRIVACY NOTICE
ACCESSIBILITY
DISCLAIMER
HHS VULNERABILITY DISCLOSURE
For language access assistance, contact the NCATS Public Information Officer
National Center for Advancing Translational Sciences (NCATS),
6701 Democracy Boulevard, Bethesda MD 20892-4874 • 301-594-8966