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Substance Name: 2',3'-Didehydro-3'-deoxy-4-thiothymidine
RN: 5983-08-4
InChIKey: AMSFVDRQDYZGRS-JGVFFNPUSA-N

Note

  • Moderately active in protecting HIV-induced cytopathogenicity of MT-2 and CEM cells.

Molecular Formula

  • C10-H12-N2-O3-S

Molecular Weight

  • 240.282
 
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Names and Synonyms

Name of Substance

  • 2',3'-Didehydro-3'-deoxy-4-thiothymidine

Synonym

  • Ddethds

Systematic Name

  • Thymidine, 2',3'-didehydro-3'-deoxy-4-thio-

Registry Numbers

CAS Registry Number

  • 5983-08-4

System Generated Number

  • 0005983084

Structure Descriptors

InChI

1S/C10H12N2O3S/c1-6-4-12(10(14)11-9(6)16)8-3-2-7(5-13)15-8/h2-4,7-8,13H,5H2,1H3,(H,11,14,16)/t7-,8+/m0/s1

InChIKey

AMSFVDRQDYZGRS-JGVFFNPUSA-N

Smiles

n1([C@@H]2O[C@H](CO)C=C2)c([nH]c(=S)c(c1)C)=O

Physical Properties

Physical Property Value Units Temp (deg C) Source
log P (octanol-water) 0.09 (none)   EXP
Water Solubility 1100 mg/L 25 EST
Vapor Pressure 3.95E-11 mm Hg 25 EST
Henry's Law Constant 2.74E-14 atm-m3/mole 25 EST
Atmospheric OH Rate Constant 1.55E-10 cm3/molecule-sec 25 EST

Physical property data is provided to ChemIDplus by SRC, Inc.