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S-23

COA

级别和纯度:

≥99%

CAS编号: 1010396-29-8
分子式: C₁₈H₁₃ClF₄N₂O₃
分子量: 416.75
PubChem编号: 24892822

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货号 (SKU)	包装规格	是否现货
S646506-5mg	5mg	期货
S646506-10mg	10mg	期货
S646506-25mg	25mg	期货
S646506-50mg	50mg	期货
S646506-100mg	100mg	期货

查看相关系列

Androgen Receptor (133) Vitamin D Related/Nuclear Receptor (908)

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基本描述

英文别名	Q7387038 \| A937568 \| Propanamide, 3-(4-chloro-3-fluorophenoxy)-N-(4-cyano-3-(trifluoromethyl)phenyl)-2-hydroxy-2-methyl-, (2S)- \| (2S)-3-(4-chloro-3-fluorophenoxy)-N-[4-cyano-3-(trifluoromethyl)phenyl]-2-hydroxy-2-methylpropanamide \| 3b5r \| C-31 \| DTXSID7
规格或纯度	≥99%
英文名称	S-23
生化机理	S-23 是一种口服活性选择性雄激素受体调节剂（SARM），其 K i 为 1.7 nM。S-23 能诱导 CV-1 细胞中雄激素受体（AR）介导的转录激活。S-23 可增加前列腺、精囊和阴茎背肌的重量。
储存温度	-20°C储存
运输条件	超低温冰袋运输
产品介绍	S-23 is an orally active selective androgen receptor modulator (SARM) with a K i of 1.7 nM. S-23 induces androgen receptor (AR)-mediated transcriptional activation in CV-1 cells. S-23 increases prostate, seminal vesicle, and levator ani muscle weights in castrated rats In Vitro S-23 induces AR-mediated transcriptional activation in CV-1 cells when used at a concentration of 10 nM. MCE has not independently confirmed the accuracy of these methods. They are for reference only. In Vivo By administration of S-23 to castrated animals, androgen-dependent organ weights increased in a dose-dependent manner. The ED 50 of S-23 in the prostate and levator ani muscle is 0.43 and 0.079 mg/d, respectively . MCE has not independently confirmed the accuracy of these methods. They are for reference only. Animal Model: Male Sprague Dawley rats (in castrated male rats) Dosage: 0.01-3 mg Administration: S.c.; daily for 14 d Result: Androgen-dependent organ weights increased in a dose-dependent manner. At a dose rate as low as 0.1 mg/d, S-23 is able to selectively maintain the weight of the levator ani muscle at the intact control level, whereas its effects on the prostate and seminal vesicles are lower than 30% of those observed in intact controls. Form:Solid IC50& Target:Ki: 1.7 nM (Androgen receptor)
纯度	≥99%

关联靶点（人）

AR Tclin 雄激素受体(Androgen receptor) (1 活性数据)

点击查看靶蛋白信息： AR

活性类型	活性值-log(M)	作用机制	期刊	参考文献(PubMed IDs)

AR Tclin Androgen Receptor (11781 活性数据)

点击查看靶蛋白信息： AR

活性类型	Relation	Activity value	Units	Action Type	期刊	PubMed Id	doi	Assay Aladdin ID

CYP2D6 Tclin Cytochrome P450 2D6 (33882 活性数据)

点击查看靶蛋白信息： CYP2D6

活性类型	Relation	Activity value	Units	Action Type	期刊	PubMed Id	doi	Assay Aladdin ID

CYP2C9 Tchem Cytochrome P450 2C9 (32119 活性数据)

点击查看靶蛋白信息： CYP2C9

活性类型	Relation	Activity value	Units	Action Type	期刊	PubMed Id	doi	Assay Aladdin ID

CYP2C19 Tchem Cytochrome P450 2C19 (29246 活性数据)

点击查看靶蛋白信息： CYP2C19

活性类型	Relation	Activity value	Units	Action Type	期刊	PubMed Id	doi	Assay Aladdin ID

CYP3A4 Tclin Cytochrome P450 3A4 (53859 活性数据)

点击查看靶蛋白信息： CYP3A4

活性类型	Relation	Activity value	Units	Action Type	期刊	PubMed Id	doi	Assay Aladdin ID

关联靶点（其它种属）

Rattus norvegicus (775804 活性数据)

点击查看此靶标相关信息

活性类型	Relation	Activity value	Units	Action Type	期刊	PubMed Id	doi	Assay Aladdin ID

作用机制

作用机制	Action Type	target ID	Target Name	Target Type	Target Organism	Binding Site Name	参考文献

名称和识别符

分子类型	小分子
IIUPAC Name	(2S)-3-(4-chloro-3-fluorophenoxy)-N-[4-cyano-3-(trifluoromethyl)phenyl]-2-hydroxy-2-methylpropanamide
INCHI	1S/C18H13ClF4N2O3/c1-17(27,9-28-12-4-5-14(19)15(20)7-12)16(26)25-11-3-2-10(8-24)13(6-11)18(21,22)23/h2-7,27H,9H2,1H3,(H,25,26)/t17-/m0/s1
InChi Key	SSFVOEAXHZGTRJ-KRWDZBQOSA-N
Smiles	CC(COC1=CC(=C(C=C1)Cl)F)(C(=O)NC2=CC(=C(C=C2)C#N)C(F)(F)F)O
Isomeric SMILES	C[C@](COC1=CC(=C(C=C1)Cl)F)(C(=O)NC2=CC(=C(C=C2)C#N)C(F)(F)F)O
关联CAS	1010396-29-8
PubChem CID	24892822
MeSH Entry Terms	1-phenyl-6,7-dimethoxy-1,2,3,4-tetrahydroisoquinoline;1-phenyl-6,7-dimethoxy-1,2,3,4-tetrahydroisoquinoline hydrochloride;1-phenyl-6,7-dimethoxy-1,2,3,4-tetrahydroisoquinoline hydrochloride, (+-)-isomer;6,7-dimethoxy-4-phenyl-1,2,3,4-tetrahydroisoquinolin
分子量	416.75

化学和物理性质

溶解性	DMSO : 100 mg/mL (239.95 mM; Need ultrasonic)
分子量	416.800 g/mol
XLogP3	3.700
氢键供体数Hydrogen Bond Donor Count	2
氢键受体数Hydrogen Bond Acceptor Count	8
可旋转键计数Rotatable Bond Count	5
精确质量Exact Mass	416.055 Da
单同位素质量Monoisotopic Mass	416.055 Da
拓扑极表面积Topological Polar Surface Area	82.400 Å²
重原子数Heavy Atom Count	28
形式电荷Formal Charge	0
复杂度Complexity	611.000
同位素原子数Isotope Atom Count	0
定义的原子立体中心计数Defined Atom Stereocenter Count	1
未定义的原子立体中心计数Undefined Atom Stereocenter Count	0
定义的键立体中心计数Defined Bond Stereocenter Count	0
未定义的键立体中心计数Undefined Bond Stereocenter Count	0
所有立体化学键的总数The total count of all stereochemical bonds	0
共价键合单元计数Covalently-Bonded Unit Count	1