Simetride

Names

[ CAS No. ]:
154-82-5

[ Name ]:
Simetride

[Synonym ]:
Piperazine,1,4-bis((2-methoxy-4-propylphenoxy)acetyl)
Simetridum [INN-Latin]
1,4-Bis-(2-methoxy-4-propyl-phenoxyacetyl)-piperazin
Kyorin AP 2
Simetride
Simetrida [INN-Spanish]
1,4-Bis((2-methoxy-4-propylphenoxy)acetyl)piperazine
Simetridum
AP 2

Biological Activity

[Description]:

Simetride is an analgesic agent. Simeicui is used for pain relief[1].

[Related Catalog]:

Signaling Pathways >> Others >> Others

Research Areas >> Neurological Disease

[References]

[1]. Mlyczyńska E, et, al. Anti-Apoptotic Effect of Apelin in Human Placenta: Studies on BeWo Cells and Villous Explants from Third-Trimester Human Pregnancy. Int J Mol Sci. 2021 Mar 9;22(5):2760.

Chemical & Physical Properties

[ Density]:
1.147g/cm3

[ Boiling Point ]:
682.6ºC at 760 mmHg

[ Molecular Formula ]:
C₂₈H₃₈N₂O₆

[ Molecular Weight ]:
498.61100

[ Flash Point ]:
366.6ºC

[ Exact Mass ]:
498.27300

[ PSA ]:
77.54000

[ LogP ]:
3.61320

[ Vapour Pressure ]:
1.73E-18mmHg at 25°C

[ Index of Refraction ]:
1.548

[ Storage condition ]:
-20°C

Toxicological Information

CHEMICAL IDENTIFICATION

RTECS NUMBER :: TK9700000

CHEMICAL NAME :: Piperazine, 1,4-bis((2-methoxy-4-propylphenoxy)acetyl)-

CAS REGISTRY NUMBER :: 154-82-5

BEILSTEIN REFERENCE NO. :: 0772468

LAST UPDATED :: 199612

DATA ITEMS CITED :: 3

MOLECULAR FORMULA :: C28-H38-N2-O6

MOLECULAR WEIGHT :: 498.68

WISWESSER LINE NOTATION :: T6N DNTJ AV1OR D3 BO1& DV1OR D3 BO1

HEALTH HAZARD DATA

ACUTE TOXICITY DATA

TYPE OF TEST :: LD50 - Lethal dose, 50 percent kill

ROUTE OF EXPOSURE :: Oral

SPECIES OBSERVED :: Rodent - rat

DOSE/DURATION :: >1025 mg/kg

TOXIC EFFECTS :: Details of toxic effects not reported other than lethal dose value

REFERENCE :: NIIRDN Drugs in Japan (Ethical Drugs). (Yakugyo Jiho Co., Ltd., Tokyo, Japan) Volume(issue)/page/year: 6,206,1982

TYPE OF TEST :: LD50 - Lethal dose, 50 percent kill

ROUTE OF EXPOSURE :: Intraperitoneal

SPECIES OBSERVED :: Rodent - rat

DOSE/DURATION :: >1 gm/kg

TOXIC EFFECTS :: Details of toxic effects not reported other than lethal dose value

REFERENCE :: YKKZAJ Yakugaku Zasshi. Journal of Pharmacy. (Nippon Yakugakkai, 2-12-15 Shibuya, Shibuya-ku, Tokyo 150, Japan) No.1- 1881- Volume(issue)/page/year: 85,715,1965

TYPE OF TEST :: LD50 - Lethal dose, 50 percent kill

ROUTE OF EXPOSURE :: Intraperitoneal

SPECIES OBSERVED :: Rodent - mouse

DOSE/DURATION :: 12 gm/kg

TOXIC EFFECTS :: Details of toxic effects not reported other than lethal dose value

REFERENCE :: 85IPAE "Modern Pharmaceuticals of Japan, III," Tokyo, Japan Pharmaceutical, Medical and Dental Supply Exporters' Assoc., 1968 Volume(issue)/page/year: -,84,1968

Safety Information

[ HS Code ]:
2933599090

Customs

[ HS Code ]: 2933599090

[ Summary ]:
2933599090. other compounds containing a pyrimidine ring (whether or not hydrogenated) or piperazine ring in the structure. VAT:17.0%. Tax rebate rate:13.0%. . MFN tariff:6.5%. General tariff:20.0%