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Chemical structure of Piperaquine phosphate

GC25754

Piperaquine phosphate

Also known as 7-chloro-4-[4-[3-[4-(7-chloroquinolin-4-yl)piperazin-1-yl]propyl]piperazin-1-yl]quinoline;phosphoric acid

Piperaquine phosphate is an orally active bisquinolone antimalarial drug

ChemicalCAS85547-56-4MW633.51FormulaC29H32Cl2N6·H3O4P
CAS number
85547-56-4
Molecular weight
633.51
Formula
C29H32Cl2N6·H3O4P
Solubility
DMSO： Insoluble;Water： 2 mg/mL (3·16 mM);
InChIKey
KATNPMSTHHZOTK-UHFFFAOYSA-N
Catalogue number
GC25754
Brand
GLPBIO
Computed properties PubChem CID 174478 · TPSA 117 Ų · H-bond donors 3 · H-bond acceptors 10
TPSA
117 Ų
H-bond donors
3
H-bond acceptors
10
Rotatable bonds
6
Heavy atoms
42

SMILES C1CN(CCN1CCCN2CCN(CC2)C3=C4C=CC(=CC4=NC=C3)Cl)C5=C6C=CC(=CC6=NC=C5)Cl.OP(=O)(O)O

Computed descriptors from PubChem (CID 174478), public domain. Identity cross-checked against the supplier's molecular formula and weight — verify before use.

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Documents
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