基本情報
- CAS
306-07-0- 標準SMILES
C#CCN(C)Cc1ccccc1.Cl- InChIKey
BCXCABRDBBWWGY-UHFFFAOYSA-N- 分子式
- C11H14ClN
- 平均分子量
- 195.69 g/mol
- 単同位体質量
- 195.0814771
概要
Pargyline Hydrochloride is the hydrochloride salt form of pargyline, a monoamine oxidase (MAO) inhibitor with antidepressant activity. Pargyline selectively inhibits MAO type B, an enzyme catalyzing the oxidative deamination and inactivation of certain catecholamines, such as norepinephrine and dopamine, within the presynaptic nerve terminals. By inhibiting the metabolism of these biogenic amines in the brain, pargyline increases their concentration and binding to postsynaptic receptors. Increased receptor stimulation may cause downregulation of central receptors which may attribute to pargyline's antidepressant effect.
名称と識別子
- 優先名称
- Pargyline Hydrochloride
- IUPAC
- N-benzyl-N-methylprop-2-yn-1-amine;hydrochloride
- 現地名
- パルギリン·塩酸塩
- 英語名
- Pargyline hydrochloride
- 分子式
- C11H14ClN
- 分子量
- 195.69
名称と別名
Pargyline hydrochloride306-07-0Pargyline HClEutonylN-Methyl-N-2-propynylbenzylamine hydrochlorideMO-911DTXSID1044647W70V6I2OMYNSC-43798A-19120DTXCID9024647NSC43798
名称をさらに表示
パルギリン塩酸塩パルギリン·塩酸塩塩酸パルギリンN-メチル-N-プロパルギルベンジルアミン·塩酸塩N-ベンジル-N-メチルプロプ-2-イン-1-アミン塩酸塩パーギリン塩酸塩パージリン 塩酸塩パルギリン・塩酸塩N-メチル-N-プロパルギルベンジルアミン・塩酸塩NSC 43798Parguline HCLpargylinechloridePARGYLINE HYDROCHLORParglycine hydrochloridePargylamine hydrochloridePargyline Hydrochloride (200 mg)PARGYLINE HYDROCHLORIDE USP/EP/BP
RefChem:58612206-175-1N-Methyl-N-propargylbenzylamine hydrochlorideN-benzyl-N-methylprop-2-yn-1-amine hydrochlorideEutonyl-tenPargyline chlorideMFCD00012492USAF A-19120
データベース識別子
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
- 3
- 重原子数
- 13
- 形式電荷
- 0
- 複雑度
- 159
実験および物理化学的性質
Human Drugs
FDA approved drugs -> Active ingredient
FDA approved drugs -> Active ingredient
Collision Cross Section134.9 Ų [M+H]+ [CCS Type: TW; Method: calibrated with polyalanine and drug standards]
物理化学的性質
- 融点
- 160 · 160-163 °C(lit.)
- 貯蔵温度
- -20 °C · -20°C
- 溶解性
- 33.55 mg/mL · ≥33.55 mg/mL in EtOH; ≥51.6 mg/mL in H2O; ≥7.55 mg/mL in DMSO
- 外見
- A crystalline solid
- 色
- 2 O · EtOH/Et2O からの結晶
- 由来生物
- synthetic
- 水溶解度
- 50 mg/mL, · water: 50mg/mL, clear, colorless to faintly yellow
- Merck
- 13 · 13,7110
- BRN
- 3699487 · 3699487
- InChI
- InChI=1S/C11H13N.ClH/c1-3-9-12(2)10-11-7-5-4-6-8-11;/h1,4-8H,9-10H2,2H3;1H
- InChIKey
- BCXCABRDBBWWGY-UHFFFAOYSA-N
- SMILES
- C1(=CC=CC=C1)CN(C)CC#C.Cl
- CAS データベース
- 306 · 306-07-0
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。
GHS分類
GHS Classification
Danger
H301 (100%): Toxic if swallowed [Danger Acute toxicity, oral]
P264, P270, P301+P316, P321, P330, P405, and P501 (click each P-code to see the statement)
Aggregated GHS information provided per 183 reports by companies from 1 notifications to the ECHA C&L Inventory.
危険有害性情報
Hazard Classes and CategoriesAcute Tox. 3 (100%)
安全データ
- F
- 10
- wgk
- 3
- rtecs
- DP6650000
- ridadr
- UN 2811 6.1/PG 3
- 毒性
- LD50 orl-rat: 250 mg/kg 27ZQAG -,401,72
- hs_code
- 2921199990
- risk_code
- 22
- hazard_code
- Xn
- safety_code
- 22-24/25
- hazard_class
- 6.1(b)
- packing_group
- III
- Hazard Classifications
- Acute Tox. 3 Oral
- ストレージクラス
- 6.1C - Combustible acute toxic Cat.3toxic compounds or compounds which causing chronic effects
化学と産業
薬理情報
MeSH Pharmacological Classification
Drugs used in the treatment of acute or chronic vascular HYPERTENSION regardless of pharmacological mechanism. Among the antihypertensive agents are DIURETICS; (especially DIURETICS, THIAZIDE); ADRENERGIC BETA-ANTAGONISTS; ADRENERGIC ALPHA-ANTAGONISTS; ANGIOTENSIN-CONVERTING ENZYME INHIBITORS; CALCIUM CHANNEL BLOCKERS; GANGLIONIC BLOCKERS; and VASODILATOR AGENTS.
A chemically heterogeneous group of drugs that have in common the ability to block oxidative deamination of naturally occurring monoamines. (From Gilman, et al., Goodman and Gilman's The Pharmacological Basis of Therapeutics, 8th ed, p414)
応用分野
使用Pargyline hydrochloride has been used: as a histone demethylase inhibitor to treat monocytes to investigate whether various inhibitors affect training to maximize uptake into dopaminergic neurons (DA) neurons in experimental rats, to study its effect on discolouration of medullary tissues of sclerotia of S. sclerotiorum
上流・下流製品情報
上流原料
サプライヤー100 社
北京华美互利生物化工010-56205725 · [email protected]
陕西科贝莱药物研发有限公司13119135307 13119135307 · [email protected]
関連反応
6 件
化合物ノート
読み込み中…