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115365-14-5 | Thymidine, 5'-[methyl P-(ethoxycarbonyl)phosphonate]
CAS No: 115365-14-5 Catalog No: AG000GN5 MDL No:
Product Description
Catalog Number:
AG000GN5
Chemical Name:
Thymidine, 5'-[methyl P-(ethoxycarbonyl)phosphonate]
CAS Number:
115365-14-5
IUPAC Name:
ethyl [[(2R,3S,5R)-3-hydroxy-5-(5-methyl-2,4-dioxopyrimidin-1-yl)oxolan-2-yl]methoxy-methoxyphosphoryl]formate
InChI:
InChI=1S/C14H21N2O9P/c1-4-23-14(20)26(21,22-3)24-7-10-9(17)5-11(25-10)16-6-8(2)12(18)15-13(16)19/h6,9-11,17H,4-5,7H2,1-3H3,(H,15,18,19)/t9-,10+,11+,26?/m0/s1
InChI Key:
BPJUTMQOQJASTN-IDMXMQQLSA-N
Properties
Complexity:
665
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
3
Defined Bond Stereocenter Count:
0
Exact Mass:
392.098g/mol
Formal Charge:
0
Heavy Atom Count:
26
Hydrogen Bond Acceptor Count:
9
Hydrogen Bond Donor Count:
2
Isotope Atom Count:
0
Molecular Weight:
392.301g/mol
Monoisotopic Mass:
392.098g/mol
Rotatable Bond Count:
8
Topological Polar Surface Area:
141A^2
Undefined Atom Stereocenter Count:
1
Undefined Bond Stereocenter Count:
0
XLogP3:
-1.2
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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