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

Details

Stereochemistry ACHIRAL
Molecular Formula C13H14ClN3
Molecular Weight 247.723
Optical Activity NONE
Defined Stereocenters 0 / 0
E/Z Centers 0
Charge 0

SHOW SMILES / InChI
Structure of 7-CHLORO-4-(PIPERAZIN-1-YL)QUINOLINE

SMILES

ClC1=CC2=NC=CC(N3CCNCC3)=C2C=C1

InChI

InChIKey=DNXNPMDUDGUXOB-UHFFFAOYSA-N
InChI=1S/C13H14ClN3/c14-10-1-2-11-12(9-10)16-4-3-13(11)17-7-5-15-6-8-17/h1-4,9,15H,5-8H2

HIDE SMILES / InChI

Molecular Formula C13H14ClN3
Molecular Weight 247.723
Charge 0
Count
Stereochemistry ACHIRAL
Additional Stereochemistry No
Defined Stereocenters 0 / 0
E/Z Centers 0
Optical Activity NONE

Approval Year

Substance Class Chemical
Created
by admin
on Sat Dec 16 10:27:49 GMT 2023
Edited
by admin
on Sat Dec 16 10:27:49 GMT 2023
Record UNII
9JZN0X101D
Record Status Validated (UNII)
Record Version
  • Download
Name Type Language
7-CHLORO-4-(PIPERAZIN-1-YL)QUINOLINE
Systematic Name English
QUINOLINE, 7-CHLORO-4-(1-PIPERAZINYL)-
Systematic Name English
PIPERAQUINE RELATED COMPOUND A [USP IMPURITY]
Common Name English
CHLOROQUINOLINYLPIPERAZINE
Common Name English
Code System Code Type Description
EPA CompTox
DTXSID50353336
Created by admin on Sat Dec 16 10:27:49 GMT 2023 , Edited by admin on Sat Dec 16 10:27:49 GMT 2023
PRIMARY
CAS
837-52-5
Created by admin on Sat Dec 16 10:27:49 GMT 2023 , Edited by admin on Sat Dec 16 10:27:49 GMT 2023
PRIMARY
PUBCHEM
738389
Created by admin on Sat Dec 16 10:27:49 GMT 2023 , Edited by admin on Sat Dec 16 10:27:49 GMT 2023
PRIMARY
FDA UNII
9JZN0X101D
Created by admin on Sat Dec 16 10:27:49 GMT 2023 , Edited by admin on Sat Dec 16 10:27:49 GMT 2023
PRIMARY
Related Record Type Details
PARENT -> IMPURITY