기본 정보
- CAS
119006-77-8- 표준 SMILES
Fc1ccc(C(c2ccccc2)(c2ccccc2F)n2ccnc2)cc1- InChIKey
QHMWCHQXCUNUAK-UHFFFAOYSA-N- 분자식
- C22H16F2N2
- 평균 분자량
- 346.4 g/mol
- 단동위원소 질량
- 346.12815484
개요
Flutrimazole is an imidazole antifungal agent that is imidazole in which the hydrogen attached to the nitrogen is replaced by a 2,4'-difluorotrityl group. A topical antifungal agent which displays potent broad-spectrum in vitro activity against dermatophytes, filamentous fungi and yeasts. It has a role as an EC 1.14.13.70 (sterol 14alpha-demethylase) inhibitor. It is a member of imidazoles, a member of monofluorobenzenes and an imidazole antifungal drug.
이름 및 식별자
- 우선 이름
- Flutrimazole
- IUPAC
- 1-[(2-fluorophenyl)-(4-fluorophenyl)-phenylmethyl]imidazole
- 영어명
- Flutrimazole
- 분자식
- C22H16F2N2
- 분자량
- 346.37
이름 및 동의어
flutrimazole119006-77-8FlutrimazolUR-4056Flutrimazolum1-[(2-fluorophenyl)(4-fluorophenyl)phenylmethyl]-1H-imidazole1-((2-Fluorophenyl)(4-fluorophenyl)phenylmethyl)-1H-imidazole1-(o-Fluoro-alpha-(p-fluorophenyl)-alpha-phenylbenzyl)imidazole776S0UP252CHEBI:82864DTXSID30869622RefChem:141078
이름 더 보기
MicetalFLUTRIMAZOLCFlutrimazole CRSC13868000 FlutrimazoleFlutrimazole And Intermediates1-((2-fluorophenyl)(4-fluorophenyl)phenylmethyl)-1h-imidazol1-[(2-fluorophenyl)-(4-fluorophenyl)phenylmethyl]-1h-imidazole
D01AC16DTXCID10817580G01AF181-[(2-fluorophenyl)-(4-fluorophenyl)-phenylmethyl]imidazole1-[(2-Fluorophenyl)(4-fluorophenyl)(phenyl)methyl]imidazoleFlutrimazole [INN]MFCD008655911-((2-Fluorophenyl)(4-fluorophenyl)(phenyl)methyl)-1H-imidazole
데이터베이스 식별자
- CAS
119006-77-8
물성
구조 계산 물성
- XLogP
- 4.6
- 극성 표면적
- 17.8 Ų
- 수소 결합 공여자 수
- 0
- 수소 결합 수용자 수
- 3
- 회전 가능 결합 수
- 4
- 무거운 원자 수
- 26
- 형식 전하
- 0
- 복잡도
- 445
실험 및 물리화학적 성질
DrugsPharmaceuticals -> Dermatologicals -> Antifungals for dermatological use
물리화학적 성질
- 녹는점
- 161 · 161-166℃
- 끓는 점
- 457.1 · 457.1±40.0 °C(Predicted)
- 밀도
- 1.15 · 1.15±0.1 g/cm3(Predicted)
- 저장 조건
- -20 °C · -20°C Freezer
- 용해도
- 물에 거의 녹지 않으며, 테트라히드로푸란에 잘 녹고, 메탄올에 녹습니다.
- 산도 계수 (pKa)
- 6.03 · 6.03±0.34(Predicted)
- 물리적 상태
- Solid
- 색상
- 흰색에서 연한 노란색
- 주요 응용
- 의약품(소분자)
- InChI
- InChI=1S/C22H16F2N2/c23-19-12-10-18(11-13-19)22(26-15-14-25-16-26,17-6-2-1-3-7-17)20-8-4-5-9-21(20)24/h1-16H
- InChIKey
- QHMWCHQXCUNUAK-UHFFFAOYSA-N
- SMILES
- C1N(C(C2=CC=CC=C2F)(C2=CC=C(F)C=C2)C2=CC=CC=C2)C=CN=1
화학적 성질
White or almost white powder.
안전 및 규제
안전 정보는 참고용이며, 공급업체의 물질안전보건자료(SDS), 관련 법규 및 전문가 평가를 대체하지 않습니다.
GHS 분류
GHS Classification
Warning
H302 (100%): Harmful if swallowed [Warning Acute toxicity, oral]
P261, P264, P264+P265, P270, P271, P280, P301+P317, P302+P352, P304+P340, P305+P351+P338, P319, P321, P330, 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.
유해성 정보
Hazard Classes and CategoriesAcute Tox. 4 (100%)
안전 데이터
- 독성
- LD50 in male, female mice, male, female rats (mg/kg): >1000, >1000, 808, 1214 orally; >2000, >2000, 1079, 1446 i.p. (Vericat)
- HS 번호
- 2933299090
화학 및 산업
약리 정보
ATC Code
G - Genito urinary system and sex hormones
D - Dermatologicals
QD - Dermatologicals
QG - Genito urinary system and sex hormones
PharmacodynamicsFlutrimazole works against dermatophytes, filamentous fungi and yeasts.
Mechanism of ActionFlutrimazole inhibits lanosterol 14 alpha-demethylase and ergosterol biosynthesis.
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.
응용 분야
개요Flutrimazole, a novel imidazole antifungal launched in Spain, is indicated for mycosis of the skin. Flutrimazole displays potent broad-spectrum of activity against dematophytes, filamentous fungi and yeasts, saprophytic and pathogenic to animals and humans. Similar to other imidazole and triazole antifungals, flutrimazole exerts its biological function through inhibition of fungal lanosterol 14a-demethylase. Excellent local and systemic tolerance of flutrimazole in patients has been reported.
용도Flutrimazole is a new imidazole antifungal agent with anti-inflammatory properties as well.
공급사78 곳
艾吉析科技（上海）有限公司17717235263 · [email protected]
BAYNOE CHEM CO.,LTD+86-21-34783353 +8615000719740 · [email protected]
河南赢创生物科技有限公司16650615803 · [email protected]
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