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Primaquine Diphosphate

CAT: 1568-C10042-01Size: 50 mgDry Ice: YesHazardous: No
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CAT#:1568-C10042-01Size:50 mg
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CAS Number
63-45-6
SKU
C10042-50mg
Target
Anti-infection
Applications
Microbiology
Smiles
CC (CCCN) NC1=C2C (=CC (=C1) OC) C=CC=N2.OP (=O) (O) O.OP (=O) (O) O
Molecular Formula
C15H21N3O.2H3O4P
Additionnal Information
Primaquine Diphosphate is a transmission-blocking anti-malarial clinically available, displaying a marked activity against gametocytes of all species of human malaria.
Storage Conditions
2 years -80 in solvent

Chemical Information

Primaquine Diphosphate

Primaquine Phosphate is the phosphate salt form of primaquine, a synthetic, 8-aminoquinoline derivative with antimalarial properties. Although its mechanism of action is unclear, primaquine bind to and alter the properties of protozoal DNA. This agent eliminates tissue (exo-erythrocytic) malarial infection, preventing the development of the erythrocytic forms of the parasite which are responsible for relapses in Plasmodium vivax and ovale malaria. Primaquine is active against late hepatic stages (hypnozoites, schizonts).

CAS Number63-45-6
PubChem CID6135
IUPAC Name4-N-(6-methoxyquinolin-8-yl)pentane-1,4-diamine;phosphoric acid
Molecular FormulaC15H27N3O9P2
Molecular Weight455.34
Topological Polar Surface Area216
Hydrogen Bond Donor Count8
Hydrogen Bond Acceptor Count12
Rotatable Bond Count6
Heavy Atom Count29
Formal Charge0
Complexity312
SMILES
CC(CCCN)NC1=C2C(=CC(=C1)OC)C=CC=N2.OP(=O)(O)O.OP(=O)(O)O
InChI
InChI=1S/C15H21N3O.2H3O4P/c1-11(5-3-7-16)18-14-10-13(19-2)9-12-6-4-8-17-15(12)14;2*1-5(2,3)4/h4,6,8-11,18H,3,5,7,16H2,1-2H3;2*(H3,1,2,3,4)
InChIKey
GJOHLWZHWQUKAU-UHFFFAOYSA-N
Chemical Structure
2D Structure
2D structure of Primaquine Diphosphate
CAS: 63-45-6
CID: 6135
Formula: C15H27N3O9P2
MW: 455.34
Interactive 3D Structure
Loading 3D structure...
Computed Properties
PropertyValue
Molecular Weight455.34
Hydrogen Bond Donor Count8
Hydrogen Bond Acceptor Count12
Rotatable Bond Count6
Exact Mass455.12225344
Monoisotopic Mass455.12225344
Topological Polar Surface Area216 Ų
Heavy Atom Count29
Formal Charge0
Complexity312
Isotope Atom Count0
Defined Atom Stereocenter Count0
Undefined Atom Stereocenter Count1
Defined Bond Stereocenter Count0
Undefined Bond Stereocenter Count0
Covalently-Bonded Unit Count3
Compound Is CanonicalizedYes

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