Introduction：Basic information about CAS 4085-31-8|piperaquine phosphate, including its chemical name, molecular formula, synonyms, physicochemical properties, and safety information, etc.
| Common Name | piperaquine phosphate |
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| CAS Number | 4085-31-8 | Molecular Weight | 535.511 |
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| Density | 1.3±0.1 g/cm3 | Boiling Point | 721.1±60.0 °C at 760 mmHg |
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| Molecular Formula | C29H32Cl2N6 | Melting Point | 198-200°C (lit.) |
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| MSDS | / | Flash Point | 389.9±32.9 °C |
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Names
| Name | Piperaquine phosphate |
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| Synonym | More Synonyms |
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piperaquine phosphate BiologicalActivity
| Description | Piperaquine is a bisquinoline antimalarial agent. Piperaquine can be used in antimalarial research in combination with Artemisinin[1][2]. |
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| Related Catalog | Research Areas >>Infection |
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| In Vivo | Piperaquine (10-90 mg/kg; a single i.p.) decreases parasitemia at all of the doses tested in mice[1]. Piperaquine (90 mg/kg; a single i.p.) exhibits the t1/2, apparent clearance, and apparent volume of distribution 17.8 days, 33.5 mg•h/L, 1.55 L/h/kg, and 956 L/kg, respectively, in healthy mice and 16.1 days, 27.3 mg•h/L, 1.9 L/h/kg, and 1,059 L/kg in malaria-infected mice[1]. |
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| References | [1]. Moore BR, et, al. Pharmacokinetics and pharmacodynamics of piperaquine in a murine malaria model. Antimicrob Agents Chemother. 2008 Jan; 52(1): 306-11. [2]. Davis TME, et, al. Piperaquine: a resurgent antimalarial drug. Drugs. 2005; 65(1): 75-87. |
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Chemical & Physical Properties
| Density | 1.3±0.1 g/cm3 |
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| Boiling Point | 721.1±60.0 °C at 760 mmHg |
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| Melting Point | 198-200°C (lit.) |
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| Molecular Formula | C29H32Cl2N6 |
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| Molecular Weight | 535.511 |
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| Flash Point | 389.9±32.9 °C |
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| Exact Mass | 534.206543 |
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| PSA | 38.74000 |
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| LogP | 5.15 |
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| Vapour Pressure | 0.0±2.3 mmHg at 25°C |
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| Index of Refraction | 1.664 |
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| InChIKey | UCRHFBCYFMIWHC-UHFFFAOYSA-N |
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| SMILES | Clc1ccc2c(N3CCN(CCCN4CCN(c5ccnc6cc(Cl)ccc56)CC4)CC3)ccnc2c1 |
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Toxicological Information
CHEMICAL IDENTIFICATION - RTECS NUMBER :
- VC3280000
- CHEMICAL NAME :
- Quinoline, 4,4'-(trimethylenedi-4,1-piperazinediyl)bis(7-chloro-
- CAS REGISTRY NUMBER :
- 4085-31-8
- BEILSTEIN REFERENCE NO. :
- 0905079
- LAST UPDATED :
- 199612
- DATA ITEMS CITED :
- 1
- MOLECULAR FORMULA :
- C29-H32-Cl2-N6
- MOLECULAR WEIGHT :
- 535.57
HEALTH HAZARD DATAACUTE TOXICITY DATA - TYPE OF TEST :
- LDLo - Lowest published lethal dose
- ROUTE OF EXPOSURE :
- Oral
- SPECIES OBSERVED :
- Rodent - mouse
- DOSE/DURATION :
- 1098 mg/kg
- TOXIC EFFECTS :
- Details of toxic effects not reported other than lethal dose value
- REFERENCE :
- CYLPDN Zhongguo Yaoli Xuebao. Acta Pharmacologica Sinica. Chinese Journal of Pharmacology. (China International Book Trading Corp., POB 2820, Beijing, Peop. Rep. China) V.1- 1980- Volume(issue)/page/year: 7,273,1986
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Safety Information
| Hazard Codes | Xi |
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| HS Code | 2942000000 |
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Customs
| HS Code | 2933990090 |
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| Summary | 2933990090. heterocyclic compounds with nitrogen hetero-atom(s) only. VAT:17.0%. Tax rebate rate:13.0%. . MFN tariff:6.5%. General tariff:20.0% |
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Synonyms
| Quinoline, 4,4'-(1,3-propanediyldi-4,1-piperazinediyl)bis[7-chloro- |
| 4,4'-(propane-1,3-diyldipiperazine-4,1-diyl)bis(7-chloroquinoline) |
| Piperaquine tetraphosphate tetrahydrate |
| 7-Chloro-4-[4-[3-[4-(7-chloroquinolin-4-yl)piperazin-1-yl]propyl]piperazin-1-yl]quinoline |
| Piperaquine |
| piperaquinoline |
| PIRERAQUINE PHOSPHATE |
| 4,4'-(1,3-Propanediyldi-4,1-piperazinediyl)bis(7-chloroquinoline) |
