基本情報
- CAS
130773-02-3- 標準SMILES
CCCCCOc1ccccc1/C(=C\SC)n1ccnc1.Cl- InChIKey
HAHMABKERDVYCH-ZUQRMPMESA-N- 分子式
- C17H23ClN2OS
- 平均分子量
- 338.9 g/mol
- 単同位体質量
- 338.1219622
概要
Neticonazole hydrochloride is a hydrochloride resulting from the formal reaction of equimolar amounts of neticonazole and hydrogen chloride. An inhibitor of P450-dependent C-14alpha-demethylation of lanosterol (preventing conversion to ergosterol and inhibiting cell wall synthesis in fungi), it is used in Japan as an antifungal drug for the treatment of superficial skin infections. It has a role as an EC 1.14.13.70 (sterol 14alpha-demethylase) inhibitor and an antifungal drug. It is a hydrochloride, an imidazole antifungal drug and a conazole antifungal drug. It contains a neticonazole(1+).
名称と識別子
- 優先名称
- Neticonazole Hydrochloride
- IUPAC
- 1-[(E)-2-methylsulfanyl-1-(2-pentoxyphenyl)ethenyl]imidazole;hydrochloride
- 現地名
- ネチコナゾール塩酸塩
- 英語名
- Neticonazole Hydrochloride
- 分子式
- C17H23ClN2OS
- 分子量
- 338.9
名称と別名
neticonazole hydrochloride130773-02-3SS717PKF582ZH6PSS-717CHEBI:31900SS 717RefChem:165543Neticonazole HClNeticonazole hydrochloride [JAN]Neticonazole (hydrochloride)(E)-1-(2-(Methylthio)-1-(2-(pentyloxy)phenyl)vinyl)-1H-imidazole hydrochloride
名称をさらに表示
1-[(E)-2-(メチルチオ)-1-[2-(ペンチルオキシ)フェニル]エテニル]-1H-イミダゾール·塩酸塩塩酸ネチコナゾールアトラントネチコナゾール塩酸塩ネチコナゾール塩酸塩 (JAN)1-[(E)-2-(メチルチオ)-1-[2-(ペンチルオキシ)フェニル]エテニル]-1H-イミダゾール・塩酸塩Atolant1-[2-methylsulfanyl-1-(2-pentoxyphenyl)ethenyl]imidazole hydrochloride1-[(E)-2-methylsulfanyl-1-(2-pentoxyphenyl)ethenyl]imidazole,hydrochloridelong-acting,colorectal,Neticonazole,antifungal,Neticonazole Hydrochloride,Imidazole,anti-cancer,nSMase2,Fungal,secretion,Inhibitor,p-ERK,anti-infection,inhibit,exosome
1-[(E)-2-methylsulfanyl-1-(2-pentoxyphenyl)ethenyl]imidazole;hydrochlorideNeticonazole hydrochloride (JAN)C17H23ClN2OSUNII-PKF582ZH6PNewralAtolant (TN)(E)-(1-(2-Pentyloxyphenyl)-1-imidazolyl-2-methylthio)ethylene hydrochloride(E)-1-(2-(Methylthio)-1-(2-(pentyloxy)phenyl)ethenyl)-1H-imidazole monohydrochloride
物性
構造計算による物性
- 極性表面積
- 52.4 Ų
- 水素結合供与体数
- 1
- 水素結合受容体数
- 3
- 回転可能結合数
- 8
- 重原子数
- 22
- 形式電荷
- 0
- 複雑度
- 322
物理化学的性質
- 融点
- 145 · 145-147°
- 貯蔵温度
- -20 °C · Store at -20°C
- 溶解性
- 250 mg/mL · DMSO: 250 mg/mL (737.68 mM)
- 外見
- Solid
- 色
- White to off-white
化学と産業
応用分野
説明Neticonazole hydrochloride is a novel imidazole antifungal agent introduced for the treatment of infections caused by Candida species. One percent neticonazole cream oncedaily application has been reported to be effective in treating patients with tinea pedis, tinea corporis, tinea cruris, intertrigo-type candidiasis, erosio interdigitalis and tinea versicolor. Compared with other agents of the azole class, neticonazole has the most potent activity against a variety of fungi, including the dermatophytes and pathogenic yeasts. It also has activity against Gram-positive, but not Gram-negative bacteria.
上流・下流製品情報
上流原料
サプライヤー54 社
Career Henan Chemica Co+86-0371-86658258 +86-13203830695 · [email protected]
武汉英诺医药科技有限公司+86-027-59232304 15387063101 · [email protected]
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