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Piperaquine-[d6]

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General Information
Catalog: BLP-003826
CAS: 1261394-71-1
Molecular Formula: C29H26D6Cl2N6
Molecular Weight: 541.5

Chemical Structure

Description	Piperaquine-[d6], is the labelled analogue of Piperaquine. Piperaquine is an antiparasitic drug used in combination with dihydroartemisinin to treat malaria.
Synonyms	Piperaquine D6; 4,4'-((propane-1,3-diyl-d6)bis(piperazine-4,1-diyl))bis(7-chloroquinoline)
IUPAC Name	7-chloro-4-[4-[3-[4-(7-chloroquinolin-4-yl)piperazin-1-yl]-1,1,2,2,3,3-hexadeuteriopropyl]piperazin-1-yl]quinoline
Related CAS	4085-31-8 (unlabelled)
Canonical SMILES	C1CN(CCN1CCCN2CCN(CC2)C3=C4C=CC(=CC4=NC=C3)Cl)C5=C6C=CC(=CC6=NC=C5)Cl
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/i1D2,10D2,11D2
InChI Key	UCRHFBCYFMIWHC-QLFBILJTSA-N
Boiling Point	721.1±60.0°C at 760 mmHg
Density	1.3±0.1 g/cm3
Storage	Store at-20°C