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115365-15-6

115365-15-6 | Uridine, 2'-deoxy-5-iodo-, 5'-[methyl (ethoxycarbonyl)phosphonate] (9CI)

CAS No: 115365-15-6 Catalog No: AG000GN4 MDL No:

Product Description

Catalog Number:
AG000GN4
Chemical Name:
Uridine, 2'-deoxy-5-iodo-, 5'-[methyl (ethoxycarbonyl)phosphonate] (9CI)
CAS Number:
115365-15-6
IUPAC Name:
ethyl [[(2R,3S,5R)-3-hydroxy-5-(5-iodo-2,4-dioxopyrimidin-1-yl)oxolan-2-yl]methoxy-methoxyphosphoryl]formate
InChI:
InChI=1S/C13H18IN2O9P/c1-3-23-13(20)26(21,22-2)24-6-9-8(17)4-10(25-9)16-5-7(14)11(18)15-12(16)19/h5,8-10,17H,3-4,6H2,1-2H3,(H,15,18,19)/t8-,9+,10+,26?/m0/s1
InChI Key:
PRQBMVNSXHMPPW-RBNARBKTSA-N

Properties

Complexity:
670  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
3  
Defined Bond Stereocenter Count:
0
Exact Mass:
503.979g/mol
Formal Charge:
0
Heavy Atom Count:
26  
Hydrogen Bond Acceptor Count:
9  
Hydrogen Bond Donor Count:
2  
Isotope Atom Count:
0
Molecular Weight:
504.17g/mol
Monoisotopic Mass:
503.979g/mol
Rotatable Bond Count:
8  
Topological Polar Surface Area:
141A^2
Undefined Atom Stereocenter Count:
1  
Undefined Bond Stereocenter Count:
0
XLogP3:
-1  

Literature

Title Journal
Phosphonoformate and phosphonoacetate derivatives of 5-substituted 2'-deoxyuridines: synthesis and antiviral activity. Journal of medicinal chemistry 19880901

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