Manidipine dihydrochloride

HCID 150762CAS 89226-75-5

部分構造検索類似構造を探す

基本情報

標準SMILES: COC(=O)C1=C(C)NC(C)=C(C(=O)OCCN2CCN(C(c3ccccc3)c3ccccc3)CC2)C1c1cccc([N+](=O)[O-])c1.Cl.Cl
InChIKey: JINNGBXKBDUGQT-UHFFFAOYSA-N
分子式: C35H40Cl2N4O6
平均分子量: 683.6 g/mol
単同位体質量: 682.23249036

概要

Manidipine dihydrochloride is a diarylmethane.

名称と識別子

優先名称: Manidipine dihydrochloride
IUPAC: 5-O-[2-(4-benzhydrylpiperazin-1-yl)ethyl] 3-O-methyl 2,6-dimethyl-4-(3-nitrophenyl)-1,4-dihydropyridine-3,5-dicarboxylate;dihydrochloride

名称と別名

Manidipine dihydrochloride89226-75-5manidipine hydrochlorideCalslotManidipine HClDTXSID9020796ZL507UZ6QLCV4093DTXCID30796RefChem:1556593-(2-(4-(Diphenylmethyl)piperazin-1-yl)ethyl) 5-methy (4RS)-2,6-dimethyl-4-(3-nitrophenyl)-1,4-dihydropyridine-3,5-dicarboxylate dihydrochlorideManidipine 2HCl

名称をさらに表示

CV-4093Franidipine hydrochloride3-(2-(4-Benzhydrylpiperazin-1-yl)ethyl) 5-methyl 2,6-dimethyl-4-(3-nitrophenyl)-1,4-dihydropyridine-3,5-dicarboxylate dihydrochlorideManidipine.2HCl126229-12-7Manidipine (dihydrochloride)MFCD00896434CV 4093

データベース識別子

CAS: 89226-75-5
PubChem CID: 150762
DTXSID: DTXSID9020796
ChEMBL: CHEMBL2362693
ChEBI: CHEBI:31800
UNII: ZL507UZ6QL
EC Number: 680-304-3

物性

構造計算による物性

極性表面積: 117 Å²
水素結合供与体数: 3
水素結合受容体数: 9
回転可能結合数: 11
重原子数: 47
形式電荷: 0
複雑度: 1,090

安全と法規制

GHS分類

GHS Classification · 5 件

This chemical does not meet GHS hazard criteria for 16.7% (1 of 6) of reports.

Danger

H301+H311+H331 (16.7%): Toxic if swallowed, in contact with skin or if inhaled [Danger Acute toxicity, oral; acute toxicity, dermal; acute toxicity, inhalation]

P203, P260, P261, P262, P264, P270, P271, P280, P301+P316, P302+P352, P304+P340, P316, P318, P319, P321, P330, P361+P364, P403+P233, P405, and P501 (click each P-code to see the statement)

Aggregated GHS information provided per 6 reports by companies from 6 notifications to the ECHA C&L Inventory. Each notification may be associated with multiple companies.

危険有害性情報

Hazard Classes and CategoriesAcute Tox. 3 (83.3%)

化学と産業

薬理情報

MeSH Pharmacological Classification · 2 件

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 class of drugs that act by selective inhibition of calcium influx through cellular membranes.