基本情報
- CAS
84485-00-7- 標準SMILES
CC(C)CC(N(C)C)C1(c2ccc(Cl)cc2)CCC1.Cl- InChIKey
UWAOJIWUVCMBAZ-UHFFFAOYSA-N- 分子式
- C17H27Cl2N
- 平均分子量
- 316.3 g/mol
- 単同位体質量
- 315.1520553
概要
Sibutramine Hydrochloride is the hydrochloride salt form of sibutramine, a phenethylamine derivative with appetite depressant property. Sibutramine hydrochloride metabolites M1 and M2 competitively inhibit the reuptake of norepinephrine, serotonin, and to a lesser degree dopamine by pre-synaptic nerve terminals, thereby promoting a sense of satiety, leading to a decrease in calorie intake, and possibly an increase in resting metabolic rate. This agent does not exhibit anticholinergic or antihistaminic effects.
名称と識別子
- 優先名称
- Sibutramine Hydrochloride
- IUPAC
- 1-[1-(4-chlorophenyl)cyclobutyl]-N,N,3-trimethylbutan-1-amine;hydrochloride
名称と別名
Sibutramine hydrochlorideSIBUTRAMINE HCl84485-00-7BTS 54524DTXSID4045927Sibutramine hydrochloride anhydrous9GG866ZP1ENSC-758928DTXCID2025927Sibutramine hydrochloride civCyclobutanemethanamine, 1-(4-chlorophenyl)-N,N-dimethyl-alpha-(2-methylpropyl)-, hydrochlorideRefChem:56625
名称をさらに表示
BTS-54524OGM0YHD1WFYeducC17H27Cl2N1-[1-(4-chlorophenyl)cyclobutyl]-N,N,3-trimethylbutan-1-amine hydrochlorideSibutramine (hydrochloride)(S)-(-)-Sibutramine hcl(R)-(+)-SIBUTRAMINE HCL
データベース識別子
- CAS
84485-00-7- PubChem CID
- 64764
- DTXSID
DTXSID4045927- ChEMBL
CHEMBL1200765、CHEMBL3989830- UNII
- 9GG866ZP1E
物性
構造計算による物性
- 極性表面積
- 3.2 Ų
- 水素結合供与体数
- 1
- 水素結合受容体数
- 1
- 回転可能結合数
- 5
- 重原子数
- 20
- 形式電荷
- 0
- 複雑度
- 275
実験および物理化学的性質
Solubility<0.7 [ug/mL] (The mean of the results at pH 7.4)
Human Drugs
FDA approved drugs -> Active ingredient
FDA approved drugs -> Active ingredient
Collision Cross Section168 Ų [M+H]+ [CCS Type: TW; Method: calibrated with polyalanine and drug standards]
安全と法規制
安全情報は参考情報です。供給元の安全データシート（SDS）、適用法令、専門家による評価に代わるものではありません。
毒性情報
Drug Induced Liver Injury
Drug Induced Liver Injury Rank (DILIrank 2.0)
Sibutramine hydrochloride
vLess-DILI-concern
4
Adverse reactions
DOI:10.1016/j.drudis.2016.02.015
化学と産業
薬理情報
MeSH Pharmacological Classification
Mood-stimulating drugs used primarily in the treatment of affective disorders and related conditions. Several MONOAMINE OXIDASE INHIBITORS are useful as antidepressants apparently as a long-term consequence of their modulation of catecholamine levels. The tricyclic compounds useful as antidepressive agents (ANTIDEPRESSIVE AGENTS, TRICYCLIC) also appear to act through brain catecholamine systems. A third group (ANTIDEPRESSIVE AGENTS, SECOND-GENERATION) is a diverse group of drugs including some that act specifically on serotonergic systems.
Agents that are used to suppress appetite.
関連反応
24 件
化合物ノート
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