Rilmazafone hydrochloride

≥99%

CAS编号: 85815-37-8
分子式: C₂₁H₂₁Cl₃N₆O₃
分子量: 511.79
PubChem编号: 9958041

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货号 (SKU)	包装规格	是否现货
R651601-5mg	5mg	期货
R651601-10mg	10mg	期货
R651601-25mg	25mg	期货
R651601-50mg	50mg	期货
R651601-100mg	100mg	期货

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基本描述

别名	盐酸利马扎酮
英文别名	Rilmazafone hydrochloride [JAN] \| CS-7384 \| AKOS040744147 \| MS-29501 \| 25T258X8BV \| 5-[[(2-aminoacetyl)amino]methyl]-1-[4-chloro-2-(2-chlorobenzoyl)phenyl]-N,N-dimethyl-1,2,4-triazole-3-carboxamide;hydrochloride \| 5-(((2-AMINOACETYL)AMINO)METHYL)-1-(4-CHL
规格或纯度	≥99%
英文名称	Rilmazafone hydrochloride
生化机理	盐酸利马唑酮（450191S）是一种苯并二氮杂卓（Ω）配体。
储存温度	2-8°C储存,干燥
运输条件	冰袋运输
产品介绍	Rilmazafone hydrochloride (450191S) is a benzodiazepine (omega) ligand. In Vivo When the animals are pretreated with high doses of Rilmazafone hydrochloride (450191-S; 200 or 600 mg/kg for 5 or 3 days, respectively) to induce hepatic drug-metabolizing enzymes, plasma concentrations of the metabolites after oral administration of a dose of 200 mg/kg of Rilmazafone decrease markedly depending on the induced enzyme activity. Pretreatment of rats with phenobarbital also causes decreased plasma levels of metabolites, which are almost the same as those in Rilmazafone-pretreatment. On the other hand, administration of beta-naphthoflavone to rats leads to higher plasma levels of metabolites, and slower elimination compared with those in the control and Rilmazafone or Phenobarbital pretreated rats. Rilmazafone is demonstrated to stimulate the hepatic drug-metabolizing enzymes in rats, mice and dogs, which is accompanied by a marked reduction in the pharmacological activity of pentobarbital in rats. The induction of hepatic enzyme activities by Rilmazafone is detected only when the plasma concentrations of its metabolites are very high. MCE has not independently confirmed the accuracy of these methods. They are for reference only. Animal administration Mice Adult male rats of the Jcl Sprague-Dawley strain, 7-8 weeks old , are used for the experiments. The animals are kept in an air-conditioned room (25±1°C, 50-60% humidity) lighted 12 hr a day (8:00-20:00) and maintain on com mercial rat chow and water ad libitum. Rilmazafone is dissolved in 5% (w/v) arabic gum at 20 or 60 mg/mL, and the resulting solution is administered orally to rats at 1.0 mL/100 g body weight for 3-5 days . Typical inducers, phenobarbital (in physiological saline) and beta-naphthoflavone (in sesame oil), are administered intraperitoneally at a dose of 40 mg/kg, once daily for 3 days. The animals are fasted for 24 hr after the last adminis tration of Rilmazafone or inducers, and then the test solution of Rilmazafone (20 mg/mL of 5% arabic gum) is given orally to rats at a dose of 200 mg/kg. Heparinized blood samples are obtained from the abdominal aorta under ether anesthesia and centrifuged immediately to obtain plasma samples using an Eppendorf centrifuge Type 5414S. aladdin has not independently confirmed the accuracy of these methods. They are for reference only. Form:Solid

名称和识别符

IUPAC Name	5-[[(2-aminoacetyl)amino]methyl]-1-[4-chloro-2-(2-chlorobenzoyl)phenyl]-N,N-dimethyl-1,2,4-triazole-3-carboxamide;hydrochloride
INCHI	InChI=1S/C21H20Cl2N6O3.ClH/c1-28(2)21(32)20-26-17(11-25-18(30)10-24)29(27-20)16-8-7-12(22)9-14(16)19(31)13-5-3-4-6-15(13)23;/h3-9H,10-11,24H2,1-2H3,(H,25,30);1H
InChi Key	KHINGHZNENOVFD-UHFFFAOYSA-N
Canonical SMILES	CN(C)C(=O)C1=NN(C(=N1)CNC(=O)CN)C2=C(C=C(C=C2)Cl)C(=O)C3=CC=CC=C3Cl.Cl
Isomeric SMILES	CN(C)C(=O)C1=NN(C(=N1)CNC(=O)CN)C2=C(C=C(C=C2)Cl)C(=O)C3=CC=CC=C3Cl.Cl
关联CAS	85815-37-8,99593-25-6 (Parent)
PubChem CID	9958041
MeSH Entry Terms	1-(2-(2-chlorobenzoyl)-4-chlorophenyl)-5-glycylaminomethyl-3-dimethylaminocarbonyl-1H-1,2,4-triazole hydrochloride;450191-S;rilmazafone;rilmazafone hydrochloride;S 450191;S-450191
分子量	511.79

化学和物理性质

溶解性	DMSO : 250 mg/mL (488.48 mM; Need ultrasonic)
分子量	511.800 g/mol
XLogP3
氢键供体数Hydrogen Bond Donor Count	3
氢键受体数Hydrogen Bond Acceptor Count	6
可旋转键计数Rotatable Bond Count	7
精确质量Exact Mass	510.074 Da
单同位素质量Monoisotopic Mass	510.074 Da
拓扑极表面积Topological Polar Surface Area	123.000 Å²
重原子数Heavy Atom Count	33
形式电荷Formal Charge	0
复杂度Complexity	696.000
同位素原子数Isotope Atom Count	0
定义的原子立体中心计数Defined Atom Stereocenter Count	0
未定义的原子立体中心计数Undefined Atom Stereocenter Count	0
定义的键立体中心计数Defined Bond Stereocenter Count	0
未定义的键立体中心计数Undefined Bond Stereocenter Count	0
所有立体化学键的总数The total count of all stereochemical bonds	0
共价键合单元计数Covalently-Bonded Unit Count	2

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基本描述

名称和识别符

化学和物理性质

安全和危险性（GHS）

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质检证书（CoA,COO,BSE/TSE 和分析图谱)

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