Terminology Service for NFDI4Health
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piperaquine

Go to external page http://purl.obolibrary.org/obo/CHEBI_91231

An aminoquinoline that is 1,3-di(piperazin-1-yl)propane in which the nitrogen at position 4 of each of the piperazine moieties is replaced by a 7-chloroquinolin-4-yl group.

Term info

Label

piperaquine

Synonyms
  • 7-chloro-4-(4-{3-[4-(7-chloroquinolin-4-yl)piperazin-1-yl]propyl}piperazin-1-yl)quinoline
database cross reference
Subsets

3_STAR

IUPAC NAME
7-chloro-4-(4-{3-[4-(7-chloroquinolin-4-yl)piperazin-1-yl]propyl}piperazin-1-yl)quinoline [ IUPAC ]

charge

0

formula

C29H32Cl2N6

has obo namespace

chebi_ontology

has related synonym

1,3-bis[4-(7-chloroquinolin-4-yl)piperazin-1-yl]propane, piperaquinoline

id

CHEBI:91231

inchi

InChI=1S/C29H32Cl2N6/c30-22-2-4-24-26(20-22)32-8-6-28(24)36-16-12-34(13-17-36)10-1-11-35-14-18-37(19-15-35)29-7-9-33-27-21-23(31)3-5-25(27)29/h2-9,20-21H,1,10-19H2

inchikey

UCRHFBCYFMIWHC-UHFFFAOYSA-N

mass

535.512

monoisotopicmass

534.20655

smiles

C12=CC=C(C=C1N=CC=C2N3CCN(CC3)CCCN4CCN(CC4)C=5C=CN=C6C5C=CC(=C6)Cl)Cl