Simeprevir

Catalog No. A11580

Simeprevir是HCV NS3/4A蛋白酶（Ki = 0.36 nM）和病毒复制（replicon EC50 = 7.8 nM）的有效抑制剂。

Technical details

Catalog Num	A11580
M. Wt	749.96
Formula	C38H47N5O7S2
Purity	>98%
Storage	at -20°C 3 years Powder
CAS No.	923604-59-5
Synonyms	TMC435, TMC435350, TMC-435350
SMILES	COC1=CC=C(C(O[C@H]2CC(C(N(C)CCCC/C=C\[C@H]3C[C@@]3(C(NS(=O)(C4CC4)=O)=O)NC5=O)=O)[C@H]5C2)=CC(C6=NC(C(C)C)=CS6)=N7)C7=C1C

Biological Activity

Simeprevir是HCV NS3/4A蛋白酶（Ki = 0.36 nM）和病毒复制（replicon EC50 = 7.8 nM）的有效抑制剂。

Solubility *

In vitro	DMSO	90 mg/mL (120.01 mM)
	Water	Insoluble
	Ethanol	4 mg/mL (5.33 mM)
* <1 mg/ml means slightly soluble or insoluble. * Please note that Adooq tests the solubility of all compounds in-house, and the actual solubility may differ slightly from published values. This is normal and is due to slight batch-to-batch variations.

Preparing Stock Solutions

Concentration / Solvent Volume / Mass	1 mg	5 mg	10 mg
0.1 mM	13.33 mL	66.67 mL	133.34 mL
0.5 mM	2.67 mL	13.33 mL	26.67 mL
1 mM	1.33 mL	6.67 mL	13.33 mL
5 mM	0.27 mL	1.33 mL	2.67 mL

*The above data is based on the productmolecular weight 749.96. Batch specific molecular weights may vary from batch to batch due to solvent of hydration, which will affect the solvent volumes required to prepare stock solutions.

Adooq Bioscience

Simeprevir

Technical details

Biological Activity

Solubility *

Preparing Stock Solutions