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Entacapone 130929-57-6

Product Description

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Molecular Weight:

305.29 Entacapone inhibits catechol-O-methyltransferase(COMT) with IC50 of 151 nM.


Biological Activity


Entacapone inhibits catechol-O-methyltransferase(COMT) with similar IC50
in different tissues including live, duodenum, kidney and lung, but
entacapone is more active than tolcapone in those tissues.


Conversion of different model animals based on BSA (Value based on data from FDA Draft Guidelines)


Species Baboon Dog Monkey Rabbit Guinea pig Rat Hamster Mouse
Weight (kg) 12 10 3 1.8 0.4 0.15 0.08 0.02
Body Surface Area (m2) 0.6 0.5 0.24 0.15 0.05 0.025 0.02 0.007
Km factor 20 20 12 12 8 6 5 3

Animal A (mg/kg) = Animal B (mg/kg) multiplied by Animal B Km
Animal A Km



For example, to modify the dose of resveratrol used for a mouse (22.4 mg/kg) to a dose based on the BSA for a rat, multiply 22.4 mg/kg by the Km factor for a mouse and then divide by the Km factor for a rat. This calculation results in a rat equivalent dose for resveratrol of 11.2 mg/kg.

Rat dose (mg/kg) = mouse dose (22.4 mg/kg) × mouse Km(3) = 11.2 mg/kg
rat Km(6)









Chemical Information




Molecular Weight (MW) 305.29
Formula

C14H15N3O5

CAS No. 130929-57-6

Storage 3 years -20℃Powder
6 months-80℃in solvent (DMSO, water, etc.)
Synonyms



Solubility (25°C) * In vitro DMSO 61 mg/mL (199.81 mM)
Water <1 mg/mL (
Ethanol 2 mg/mL (6.55 mM)
* <1 mg/ml means slightly soluble or insoluble.
* Please note that Selleck 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.




Chemical Name (E)-2-cyano-3-(3,4-dihydroxy-5-nitrophenyl)-N,N-diethylacrylamide







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Product Categories : Epigenetics > Histone Methyltransferase Inhibitor