기본 정보
- 표준 SMILES
CNCCCN1c2ccccc2CCc2ccccc21.Cl- InChIKey
XAEWZDYWZHIUCT-UHFFFAOYSA-N- 분자식
- C18H23ClN2
- 평균 분자량
- 302.8 g/mol
- 단동위원소 질량
- 302.15497642
개요
Desipramine Hydrochloride is the hydrochloride salt form of desipramine, a secondary amine tricyclic antidepressant (TCA). In the central nervous system (CNS), desipramine hydrochloride blocks the re-uptake of neurotransmitters, including norepinephrine and serotonin. This leads to an increase in the amount of these neurotransmitters in the synaptic cleft and prolongs their activities postsynaptically.
이름 및 식별자
- 우선 이름
- Desipramine Hydrochloride
- IUPAC
- 3-(5,6-dihydrobenzo[b][1]benzazepin-11-yl)-N-methylpropan-1-amine;hydrochloride
이름 및 동의어
Desipramine hydrochloride58-28-6Desipramine HclDMI hydrochlorideRMI 9,384ADesmethylimipramine chlorideDesimipramine, hydrochlorideNSC-114901Desipramine monohydrochlorideEX 4355Demethylimipramine hydrochlorideImipraminedemethyl hydrochloride
이름 더 보기
G-35020Desmethylimipramine hydrochlorideJB-8181Desmethylimipramine monohydrochlorideDTXSID90469421Y58DO4MY1RMI-9384AEX-4355
데이터베이스 식별자
- CAS
58-28-6- PubChem CID
- 65327
- DTXSID
DTXSID9046942- ChEMBL
CHEMBL1696- UNII
- 1Y58DO4MY1
- EC Number
- 200-373-1
물성
구조 계산 물성
- 극성 표면적
- 15.3 Ų
- 수소 결합 공여자 수
- 2
- 수소 결합 수용자 수
- 2
- 회전 가능 결합 수
- 4
- 무거운 원자 수
- 21
- 형식 전하
- 0
- 복잡도
- 267
실험 및 물리화학적 성질
Solubility>45.4 [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 Section162.1 Ų [M+H]+ [CCS Type: TW; Method: calibrated with polyalanine and drug standards]
안전 및 규제
GHS 분류
GHS Classification
Danger
H302 (97.9%): Harmful if swallowed [Warning Acute toxicity, oral]
P233, P260, P261, P264, P264+P265, P270, P271, P272, P280, P284, P301+P317, P302+P352, P304+P340, P305+P351+P338, P319, P321, P330, P332+P317, P333+P317, P337+P317, P342+P316, P362+P364, P403, P403+P233, P405, and P501 (click each P-code to see the statement)
Aggregated GHS information provided per 47 reports by companies from 9 notifications to the ECHA C&L Inventory. Each notification may be associated with multiple companies.
유해성 정보
Regulatory Information
Status: Active Update: 07-12-2017 https://echa.europa.eu/registration-dossier/-/registered-dossier/21340
5H-Dibenzb,fazepine-5-propanamine, 10,11-dihydro-N-methyl-, monohydrochloride: Does not have an individual approval but may be used under an appropriate group standard
Other Safety InformationIMAP assessments - 5H-Dibenz[b,f]azepine-5-propanamine, 10,11-dihydro-N-methyl-, monohydrochloride: Human health tier I assessment
Hazard Classes and CategoriesAcute Tox. 4 (97.9%)
독성 정보
Drug Induced Liver Injury
Drug Induced Liver Injury Rank (DILIrank 2.0)
Desipramine hydrochloride
Ambiguous-DILI-concern
3
Adverse reactions
DOI:10.1016/j.drudis.2016.02.015
화학 및 산업
약리 정보
FDA Pharmacological Classification
DESIPRAMINE HCL
Tricyclic Antidepressant [EPC]
DESIPRAMINE HYDROCHLORIDE
Tricyclic Antidepressant [EPC]
MeSH Pharmacological Classification
Substances that contain a fused three-ring moiety and are used in the treatment of depression. These drugs block the uptake of norepinephrine and serotonin into axon terminals and may block some subtypes of serotonin, adrenergic, and histamine receptors. However, the mechanism of their antidepressant effects is not clear because the therapeutic effects usually take weeks to develop and may reflect compensatory changes in the central nervous system.
Compounds or agents that combine with an enzyme in such a manner as to prevent the normal substrate-enzyme combination and the catalytic reaction.
Drugs that block the transport of adrenergic transmitters into axon terminals or into storage vesicles within terminals. The tricyclic antidepressants (ANTIDEPRESSIVE AGENTS, TRICYCLIC) and amphetamines are among the therapeutically important drugs that may act via inhibition of adrenergic transport. Many of these drugs also block transport of serotonin.
관련 반응
16건
연결된 노트
불러오는 중…