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1-[2-메틸설파닐-1-(2-펜톡시페닐)에테닐]이미다졸염산염

Neticonazole Hydrochloride

HCID 5282432
노트반응
기본 정보개요이름 및 식별자물성화학 및 산업관련 반응화합물 노트
부분 구조 검색유사 구조 찾기

기본 정보

CAS
130773-02-3
표준 SMILES
CCCCCOc1ccccc1/C(=C\SC)n1ccnc1.Cl
InChIKey
HAHMABKERDVYCH-ZUQRMPMESA-N
분자식
C17H23ClN2OS
평균 분자량
338.9 g/mol
단동위원소 질량
338.1219622

개요

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+).

이름 및 식별자

우선 이름
Neticonazole Hydrochloride
IUPAC
1-[(E)-2-methylsulfanyl-1-(2-pentoxyphenyl)ethenyl]imidazole;hydrochloride
현지명
1-[2-메틸설파닐-1-(2-펜톡시페닐)에테닐]이미다졸염산염
영어명
Neticonazole Hydrochloride
분자식
C17H23ClN2OS
분자량
338.9

이름 및 동의어

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
이름 더 보기
1-[2-메틸설파닐-1-(2-펜톡시페닐)에테닐]이미다졸염산염Atolant1-[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

물성

구조 계산 물성

극성 표면적
52.4 Ų
수소 결합 공여자 수
1
수소 결합 수용자 수
3
회전 가능 결합 수
8
무거운 원자 수
22
형식 전하
0
복잡도
322

물리화학적 성질

녹는점
145 · 145-147°
저장 조건
-20 °C · Store at -20°C
용해도
250 mg/mL · DMSO: 250 mg/mL (737.68 mM)
물리적 상태
Solid
색상
White to off-white

화학 및 산업

응용 분야 · 1건

개요Neticonazole 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.

상·하류 제품 정보

상류 원료

옥소아밀1-브로모펜탄Phenol, 2-[1-(1H-imidazol-1-yl)-2-(methylthio)ethenyl]-염산수산화칼륨N,N-다이메틸폼아마이드물초산에틸

공급사54 곳

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]
成都超九八生物科技有限公司13348960310 13348960310 · [email protected]

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데이터베이스 식별자

CAS
130773-02-3
PubChem CID
5282432
ChEBI
CHEBI:31900
UNII
PKF582ZH6P
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Aladdin Scientific[email protected]
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TargetMol中国(陶术生物)4008200310 15002144251 · [email protected]
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常州英飒医药科技有限公司15151934985 · [email protected]
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DAYANG CHEM (HANGZHOU) CO.,LTD+86-88938639 +86-17705817739 · [email protected]
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