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Product details

名称

AGI-24512

分子类型

未知

英文名称

AGI-24512

货号

A650415-5mg

包装规格

5mg

浓度

≥99%

储存温度

-20°C储存

运输条件

超低温冰袋运输

产品介绍

AGI-24512 is a potent methionine adenosyltransferase 2α ( MAT2A ) inhibitor, with an IC 50 of 8 nM. AGI-24512 triggers DNA damage response. AGI-24512 can block proliferation of MTAP-deleted cancer cells in vitro . AGI-24512 can be used for researching anticancer In Vitro AGI-24512 (0-1 μM; 96 hours) blocks proliferation of MTAP (methylthioadenosine phosphorylase)-deleted HCT116 cancer cells with an IC 50 of 100 nM. AGI-24512 significantly increases in γH2AX-positive cells in MTAP -/- HCT116 cells. AGI-24512 inhibits PRMT5-mediated SDMA marks with an IC 50 of 95 nM in MTAP -/- cells. AGI-24512 leads to a dose-dependent decrease in SAM (S-adenosylmethionine) levels in the HCT116 MTAP- cell, with an IC 50 of 100 nM. MCE has not independently confirmed the accuracy of these methods. They are for reference only. In Vivo AGI-24512 shows poor oral absorption and a short half-life in rats. MCE has not independently confirmed the accuracy of these methods. They are for reference only. Form:Solid IC50& Target:IC50: 8 nM (MAT2A)

生化机理

AGI-24512 是一种强效的蛋氨酸腺苷转移酶 2α （MAT2A）抑制剂，IC50 为 8 nM。AGI-24512 触发 DNA 损伤反应。AGI-24512 可在体外阻断缺失 MTAP 的癌细胞的增殖。AGI-24512 可用于研究抗肿瘤药物。

CAS号

2201066-53-5

分子式

C24H24N4O2

分子量

400.47 g/mol

PubChem编号

134307780

Isomeric SMILES

CC1=C(C(=O)N2C(=N1)C(=C(N2)C3=CC=CC=C3)N4CCCCC4)C5=CC=C(C=C5)O

IIUPAC Name

6-(4-hydroxyphenyl)-5-methyl-2-phenyl-3-piperidin-1-yl-1H-pyrazolo[1,5-a]pyrimidin-7-one

INCHI

1S/C24H24N4O2/c1-16-20(17-10-12-19(29)13-11-17)24(30)28-23(25-16)22(27-14-6-3-7-15-27)21(26-28)18-8-4-2-5-9-18/h2,4-5,8-13,26,29H,3,6-7,14-15H2,1H3

InChi Key

VFEXODVWKUOZBF-UHFFFAOYSA-N

Smiles

CC1=C(C(=O)N2C(=N1)C(=C(N2)C3=CC=CC=C3)N4CCCCC4)C5=CC=C(C=C5)O

PubChem CID

134307780

溶解性

DMSO : 125 mg/mL (312.13 mM; Need ultrasonic)

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

400.19 Da

单同位素质量Monoisotopic Mass

400.19 Da

拓扑极表面积Topological Polar Surface Area

68.200 Å²

重原子数Heavy Atom Count

形式电荷Formal Charge

复杂度Complexity

779

同位素原子数Isotope Atom Count

共价键合单元计数Covalently-Bonded Unit Count

XLogP3

4.1

Safety

「No Dangerous Attributes」

「No upstream and downstream information yet」

Technical Documents

「No technical documents」

Articles

「No related articles yet」

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