3-Cyclobutene-1,2-dione, 3-(1,3-benzodioxol-5-ylamino)-4-[(2-pyridinylmethyl)amino]-;Mtb ATP synthase-IN-1
Cas No.
2642394-38-3
分子式
C17H13N3O4
分子量
323.30
包装储存
Powder -20°C 3 years;4°C 2 years
产品详情
Mtb ATP synthase-IN-1 (compound 6ab) 是一种有效的 结核分枝杆菌 (Mtb) ATP 合成抑制剂,对 Mtb 的 MIC 为 0.452 ~ 0.499 μg/mL。Mtb ATP synthase-IN-1 代谢稳定性好,细胞毒性低 (Vero IC50 > 64 μg/mL),具有一定的口服生物利用度。Mtb ATP synthase-IN-1 可用于抗结核分枝杆菌的研究。
生物活性
Mtb ATP synthase-IN-1 (compound 6ab) is a potent Mycobacterium tuberculosis (Mtb) ATP synthase inhibitor, with MIC of 0.452-0.499 μg/mL against Mtb. Mtb ATP synthase-IN-1 has good metabolic stability, low cytotoxicity (Vero IC 50 > 64 μg/mL), and acceptable oral bioavailability. Mtb ATP synthase-IN-1 can be used for researching anti-mycobacterium.
性状
Solid
IC50 & Target[1][2]
MIC: 0.452-0.499 μg/mL (Mtb)
体内研究(In Vivo)
Mtb ATP synthase-IN-1 (50 mg/kg for PO, 5 mg/kg for IV; single dosage) exhibits good metabolic stability and acceptable oral bioavailability.
Pharmacokinetic Parameters of Mtb ATP synthase-IN-1 in male CD-1 mouse. PO (50 mg/kg)
IV (5 mg/kg)
运输条件
Room temperature in continental US; may vary elsewhere.
储存方式
Powder -20°C 3 years;4°C 2 years
参考文献
[1]. Li P, et al. Design, synthesis and biological evaluation of diamino substituted cyclobut-3-ene-1,2-dione derivatives for the treatment of drug-resistant tuberculosis. Eur J Med Chem. 2020;206:112538.
溶解度数据
In Vitro: DMSO : 125 mg/mL (386.64 mM; Need ultrasonic)配制储备液