기본 정보
- CAS
223132-38-5- 표준 SMILES
Cc1cc(Oc2ccc3nc(COc4ccc(CC5SC(=O)NC5=O)cc4)n(C)c3c2)cc(C)c1N.Cl.Cl- InChIKey
WFIOHOJEIMQCEG-UHFFFAOYSA-N- 분자식
- C27H28Cl2N4O4S
- 평균 분자량
- 575.5 g/mol
개요
Efatutazone Dihydrochloride is the dihydrochloride salt of efatutazone, an orally bioavailable agonist of peroxisome proliferator-activated receptor gamma (PPAR-gamma) with potential antineoplastic activity. Efatutazone binds to and activates PPAR-gamma, a nuclear hormone receptor and a ligand-activated transcription factor controling gene expression involved in macromolecule metabolism and cell differentiation, specifically adipocyte differentiation. Mediated through activation of PPAR-gamma, this agent is capable of inducing cell differentiation and apoptosis, thereby leading to a reduction in cellular proliferation.
이름 및 식별자
- 우선 이름
- Efatutazone Dihydrochloride
- IUPAC
- 5-[[4-[[6-(4-amino-3,5-dimethylphenoxy)-1-methylbenzimidazol-2-yl]methoxy]phenyl]methyl]-1,3-thiazolidine-2,4-dione;dihydrochloride
- 영어명
- CS 7017
- 분자식
- C27H28Cl2N4O4S
- 분자량
- 575.50662
이름 및 동의어
Inolitazone dihydrochlorideEfatutazone hydrochlorideefatutazone dihydrochlorideCS-7017RS544476B44WEA8ORefChem:920845223132-38-5Inolitazone (dihydrochloride)CS 7017UNII-76B44WEA8OCS7017
이름 더 보기
RS5444 dihydrochlorideCS-7017 dihydrochlorideInolitazone (CS-7017) 2HClInolitazone (CS-7017) dihydrochlorideEFATUTAZONERS 54445-[[4-[[6-(4-amino-3,5-dimethylphenoxy)-1-methylbenzimidazol-2-yl]methoxy]phenyl]methyl]-1,3-thiazolidine-2,4-dione5-[[4-[[6-(4-Amino-3,5-dimethylphenoxy)-1-methyl-1H-benzimidazol-2-yl]methoxy]phenyl]methyl]-2,4-thiazolidinedione dihydrochloride
RS-54442,4-Thiazolidinedione, 5-((4-((6-(4-amino-3,5-dimethylphenoxy)-1-methyl-1H-benzimidazol-2-yl)methoxy)phenyl)methyl)-, dihydrochloride5-[[4-[[6-(4-amino-3,5-dimethylphenoxy)-1-methylbenzimidazol-2-yl]methoxy]phenyl]methyl]-1,3-thiazolidine-2,4-dione;dihydrochlorideEfatutazone (dihydrochloride);CS-7017 (dihydrochloride);RS5444 (dihydrochloride)MFCD131947725-[4-[6-(4-amino-3,5-dimethylphenoxy)-1-methyl-1H-benzimidazol-2-ylmethoxy]benzyl]thiazolidine-2,4-dione dihydrochloride5-{4-[6-(4-amino-3,5-dimethylphenoxy)-1-methyl-1H-benzimidazol-2-ylmethoxy]benzyl}thiazolidine-2,4-dione dihydrochlorideC27H28Cl2N4O4S
물성
구조 계산 물성
- 극성 표면적
- 134 Ų
- 수소 결합 공여자 수
- 4
- 수소 결합 수용자 수
- 7
- 회전 가능 결합 수
- 7
- 무거운 원자 수
- 38
- 형식 전하
- 0
- 복잡도
- 782
물리화학적 성질
- 저장 조건
- -20 °C · Store at -20°C
- 용해도
- 25 mg/mL · DMSO : 25 mg/mL (43.44 mM; Need ultrasonic)H2O : < 0.1 mg/mL (insoluble)
- 물리적 상태
- 가루
- 색상
- Pale purple to purple
화학 및 산업
약리 정보
MeSH Pharmacological ClassificationSubstances that inhibit or prevent the proliferation of NEOPLASMS.
공급사23 곳
陕西缔都医药有限责任公司029-81124775 17791530730 · [email protected]
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Aladdin Scientific[email protected]
United Life Science020-82099279 18988968278 · [email protected]
MedBio脉铂医药021-69568360 18916172912 · [email protected]
銳迪國際科技有限公司18024082417 · [email protected]
MedChemexpress LLC021-58955995 · [email protected]
BOC Sciences1-631-485-4226; 16314854226 · [email protected]
AdooQ BioScience, LLC+1 (866) 930-6790 · [email protected]
上海陶术生物科技股份有限公司+1-781-999-5354; +1-00000000000 · [email protected]
斯派螺（武汉）药物研发有限公司[email protected]
广州市齐云生物技术有限公司020-61288194 61288195 · [email protected]
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