TrifluorothymidineA substrate used to study the specificity and kinetics of thymidine kinases

Trifluorothymidine (CAS 70-00-8)

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Synonym: 2'-Deoxy-5-trifluoromethyluridine; Trifluorothymine deoxyriboside; Trifluridine
Application: A substrate used to study the specificity and kinetics of thymidine kinases
CAS Number: 70-00-8
Molecular Weight: 296.20
Molecular Formula: C10H11F3N2O5
* Refer to Certificate of Analysis for lot specific data (including water content).
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Trifluorothymidine is an inhibitor of TS (thymidylate synthase). It is also a substrate used to study the specificity and kinetics of thymidine kinases.

Appearance :
Powder
Physical State :
Solid
Solubility :
Soluble in water (59 mg/ml), DMSO (59 mg/ml), ethanol (59 mg/ml), methanol, and isopropanol (Slightly).
Storage :
Store at -20° C
Melting Point :
190-193° C (lit.)
Boiling Point :
521.82° C (Predicted)
Density :
~1.6 g/cm3 (Predicted)
Refractive Index :
n20D 1.53 (Predicted)
Optical Activity :
α20D +53.8°, c = 1 in water
IC50 :
ADMET: IC50 = 20 nM (mouse); Thymidine kinase: IC50 = 2 µM (Macacine herpesvirus 1); Duck hepatitis B virus: EC5050 = 3.37 µM; Hepatitis B virus: EC5050 = 33.7 µM
Ki Data :
Thymidylate kinase: Ki= 97 µM (Mycobacterium tuberculosis)
pK Values :
pKa: 7.95
For Research Use Only. Not Intended for Diagnostic or Therapeutic Use.
WGK Germany :
3
RTECS :
XP2087500
PubChem CID :
6256
Merck Index :
14: 9687
MDL Number :
MFCD00006534
EC Number :
200-722-8
Beilstein Registry :
568095
SMILES :
C1[C@@H]([C@H](O[C@H]1N2C=C(C(=O)NC2=O)C(F)(F)F)CO)O

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Trifluorothymidine  Product Citations

See how others have used Trifluorothymidine. Click on the entry to view the PubMed entry .

Citations 1 to 1 of 1 total

PMID: # 26636185  Othman, E.M. et al. 2016. Endocrinology. 157: 548-59.

Citations 1 to 1 of 1 total

We would like to purchase dozens gram. Is it possible to share the data of IR and NMR for our reference?

Asked by: Hiromasa Kondo
Thank you for your question. Please contact our Technical Service Department and we will be happy to assist you. You may call us directly at 001 800-1338-3838, email at asia@scbio.cn, or contact us by live chat.
Answered by: Technical Support 8
Date published: 2018-01-09
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