기본 정보
- CAS
84485-00-7- 표준 SMILES
CC(C)CC(N(C)C)C1(c2ccc(Cl)cc2)CCC1.Cl- InChIKey
UWAOJIWUVCMBAZ-UHFFFAOYSA-N- 분자식
- C17H27Cl2N
- 평균 분자량
- 316.3 g/mol
- 단동위원소 질량
- 315.1520553
개요
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.
이름 및 식별자
- 우선 이름
- Sibutramine Hydrochloride
- IUPAC
- 1-[1-(4-chlorophenyl)cyclobutyl]-N,N,3-trimethylbutan-1-amine;hydrochloride
이름 및 동의어
Sibutramine hydrochlorideSIBUTRAMINE HCl84485-00-7BTS 54524DTXSID4045927Sibutramine hydrochloride anhydrous9GG866ZP1ENSC-758928DTXCID2025927Sibutramine hydrochloride civCyclobutanemethanamine, 1-(4-chlorophenyl)-N,N-dimethyl-alpha-(2-methylpropyl)-, hydrochlorideRefChem:56625
이름 더 보기
BTS-54524OGM0YHD1WFYeducC17H27Cl2N1-[1-(4-chlorophenyl)cyclobutyl]-N,N,3-trimethylbutan-1-amine hydrochlorideSibutramine (hydrochloride)(S)-(-)-Sibutramine hcl(R)-(+)-SIBUTRAMINE HCL
데이터베이스 식별자
- CAS
84485-00-7- PubChem CID
- 64764
- DTXSID
DTXSID4045927- ChEMBL
CHEMBL1200765、CHEMBL3989830- UNII
- 9GG866ZP1E
물성
구조 계산 물성
- 극성 표면적
- 3.2 Ų
- 수소 결합 공여자 수
- 1
- 수소 결합 수용자 수
- 1
- 회전 가능 결합 수
- 5
- 무거운 원자 수
- 20
- 형식 전하
- 0
- 복잡도
- 275
실험 및 물리화학적 성질
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]
안전 및 규제
안전 정보는 참고용이며, 공급업체의 물질안전보건자료(SDS), 관련 법규 및 전문가 평가를 대체하지 않습니다.
독성 정보
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
화학 및 산업
약리 정보
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.
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