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Product details

名称

IWP-3

分子类型

小分子

英文别名

英文名称

IWP-3

货号

I647349-5mg

包装规格

5mg

浓度

≥98%

储存温度

-20°C储存

运输条件

超低温冰袋运输

产品介绍

IWP-3 is an potent inhibitor of Wnt production with an IC 50 of 40 nM. IWP-3 inhibits Porcupine (Porcn) function thereby blocking palmitoylation of Wnt proteins. IWP-3 inhibits CK1γ3 and CK1ε only moderately and does not inhibit CK1α. Form:Solid

生化机理

IWP-3 是一种有效的 Wnt 生成抑制剂，IC50 为 40 nM。IWP-3 可抑制 Porcupine（Porcn）的功能，从而阻断 Wnt 蛋白的棕榈酰化。IWP-3 对 CK1γ3 和 CK1ε 的抑制作用较弱，对 CK1α 没有抑制作用。

CAS号

687561-60-0

分子式

C22H17FN4O2S3

分子量

484.59 g/mol

PubChem编号

2155389

Isomeric SMILES

CC1=CC2=C(C=C1)N=C(S2)NC(=O)CSC3=NC4=C(C(=O)N3C5=CC=C(C=C5)F)SCC4

IIUPAC Name

2-[[3-(4-fluorophenyl)-4-oxo-6,7-dihydrothieno[3,2-d]pyrimidin-2-yl]sulfanyl]-N-(6-methyl-1,3-benzothiazol-2-yl)acetamide

INCHI

1S/C22H17FN4O2S3/c1-12-2-7-15-17(10-12)32-21(24-15)26-18(28)11-31-22-25-16-8-9-30-19(16)20(29)27(22)14-5-3-13(23)4-6-14/h2-7,10H,8-9,11H2,1H3,(H,24,26,28)

InChi Key

XVMHQSDMKWQNBK-UHFFFAOYSA-N

Smiles

CC1=CC2=C(C=C1)N=C(S2)NC(=O)CSC3=NC4=C(C(=O)N3C5=CC=C(C=C5)F)SCC4

PubChem CID

2155389

溶解性

DMSO : 25 mg/mL (51.59 mM; ultrasonic and warming and heat to 60°C)

氢键供体数Hydrogen Bond Donor Count

氢键受体数Hydrogen Bond Acceptor Count

可旋转键计数Rotatable Bond Count

精确质量Exact Mass

484.05 Da

单同位素质量Monoisotopic Mass

484.05 Da

拓扑极表面积Topological Polar Surface Area

154.000 Å²

重原子数Heavy Atom Count

形式电荷Formal Charge

复杂度Complexity

830

同位素原子数Isotope Atom Count

共价键合单元计数Covalently-Bonded Unit Count

XLogP3

4.9

RIDADR

NONHforallmodesoftransport

Safety

「No Dangerous Attributes」

「No upstream and downstream information yet」

Technical Documents

「No technical documents」

Articles

「No related articles yet」

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