Sertaconazole Nitrate (HCID 200103)

概要

Sertaconazole Nitrate is the nitrate salt form of sertaconazole, a synthetic imidazole derivative with antifungal property. Sertaconazole nitrate inhibits fungal cytochrome P-450 sterol C-14 alpha-demethylation, resulting in the accumulation of fungal 14 alpha-methyl sterols and the inhibition of ergosterol synthesis, an essential component of the cell membrane of fungi. This leads to a disruption of cell membrane permeability and leakage of adenine triphosphate (ATP) and other constituents from fugal cells.

名称と識別子

優先名称: Sertaconazole Nitrate
IUPAC: 1-[2-[(7-chloro-1-benzothiophen-3-yl)methoxy]-2-(2,4-dichlorophenyl)ethyl]imidazole;nitric acid
現地名: セルタコナゾール硝酸塩
英語名: Sertaconazole nitrate
分子式: C20H15Cl3N2OS.HNO3
分子量: 500.78

名称と別名

Sertaconazole nitrate99592-39-9DermofixErtaczoZalainDermovitSertaconazole mononitrateFI 7056DTXSID20455291DV05410M5FI-7056DTXCID0025529

名称をさらに表示

セルタコナゾール硝酸塩SEROTONINGinedermofixSertaconazle NitrateNITRATE SERTACONAZOLE

1H-Imidazole, 1-(2-((7-chlorobenzo(b)thien-3-yl)methoxy)-2-(2,4-dichlorophenyl)ethyl)-, mononitrateRefChem:56606CHEBI:83687DermosepticFisdermExtensOnabetSertaconazole (nitrate)

データベース識別子

CAS: 99592-39-9
PubChem CID: 200103
DTXSID: DTXSID2045529
ChEMBL: CHEMBL1200725
UNII: 1DV05410M5
EC Number: 893-241-3

物性

構造計算による物性

極性表面積: 121 Å²
水素結合供与体数: 1
水素結合受容体数: 6
回転可能結合数: 6
重原子数: 31
形式電荷: 0
複雑度: 513

実験および物理化学的性質

Human Drugs · 2 件

FDA approved drugs -> Active ingredient

物理化学的性質

融点: 158 · 158-160°
貯蔵温度: -20 °C · -20°C
溶解性: 20 mg/mL、透明 · DMSO：可溶20mg/mL、透明
酸解離定数(Pka): 7.26 · pKb: 7.26(at 25℃)
外見: 粉
色: 白からベージュ
InChI: 1S/C20H15Cl3N2OS.HNO3/c21-14-4-5-16(18(23)8-14)19(9-25-7-6-24-12-25)26-10-13-11-27-20-15(13)2-1-3-17(20)22;2-1(3)4/h1-8,11-12,19H,9-10H2;(H,2,3,4)
InChIKey: HAAITRDZHUANGT-UHFFFAOYSA-N
SMILES: [s]1c2c(c(c1)COC(C[n]4cncc4)c3c(cc(cc3)Cl)Cl)cccc2Cl.[N+](=O)([O-])O

化学的性質

化学的特性Off-White Solid

安全と法規制

GHS分類

GHS Classification · 4 件

Warning

H315 (100%): Causes skin irritation [Warning Skin corrosion/irritation]

P261, P264, P264+P265, P271, P280, P302+P352, P304+P340, P305+P351+P338, P319, P321, P332+P317, P337+P317, P362+P364, P403+P233, P405, and P501 (click each P-code to see the statement)

The GHS information provided by 1 company from 1 notification to the ECHA C&L Inventory.

危険有害性情報

Hazard Classes and CategoriesSkin Irrit. 2 (100%)

毒性情報

Exposure RoutesBioavailability is negligible.

Toxicity Summary · 1 件

Sertaconazole interacts with 14-α demethylase, a cytochrome P-450 enzyme necessary to convert lanosterol to ergosterol. As ergosterol is an essential component of the fungal cell membrane, inhibition of its synthesis results in increased cellular permeability causing leakage of cellular contents. Sertaconazole may also inhibit endogenous respiration, interact with membrane phospholipids, inhibit the transformation of yeasts to mycelial forms, inhibit purine uptake, and impair triglyceride and/or phospholipid biosynthesis.

Carcinogen ClassificationNo indication of carcinogenicity to humans (not listed by IARC).

安全データ

wgk: 3
Hazard Classifications: Repr. 2
ストレージクラス: 11 - Combustible Solids

化学と産業

薬理情報

FDA Pharmacological Classification · 2 件

SERTACONAZOLE NITRATE

Azoles [CS]; Azole Antifungal [EPC]

MeSH Pharmacological ClassificationSubstances that destroy fungi by suppressing their ability to grow or reproduce. They differ from FUNGICIDES, INDUSTRIAL because they defend against fungi present in human or animal tissues.

用途と製造

UsesFor the topical treatment of interdigital tinea pedis in immunocompetent patients 12 years of age and older, caused by Trichophyton rubrum, Trichophyton mentagrophytes, and Epidermophyton floccosum.

応用分野 · 2 件

説明Sertaconazole nitrate is a new broad spectrum imidazole antifungal agent introduced in a topical formulation for the treatment of cutaneous infections. Its mechanism of action is the inhibition of ergosterol synthesis and interference with the permeability of fungus cell membranes. An oral formulation is currently under investigation for the treatment of bucco-pharyngeal fungal infections.

使用An imidazole antifungal agent, inhibits the synthesis of ergosterol, an essential cell wall component of fungi.

サプライヤー50 社

上海阿拉丁生化科技股份有限公司400-6206333 13167063860 · [email protected]

南通飞宇生物科技有限公司0513-68819626 15152877458 · [email protected]

Career Henan Chemica Co+86-0371-86658258 +86-13203830695 · [email protected]

湖北威德利化学试剂有限公司181-6332-1995 18062128043 · [email protected]

艾吉析科技（上海）有限公司17717235263 · [email protected]

セルタコナゾール硝酸塩

基本情報

概要