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Home > Fluorides > 122757-52-2
122757-52-2 | Uridine, 2',3'-didehydro-2',3'-dideoxy-2'-fluoro-
CAS No: 122757-52-2 Catalog No: AG000JBL MDL No:
Product Description
Catalog Number:
AG000JBL
Chemical Name:
Uridine, 2',3'-didehydro-2',3'-dideoxy-2'-fluoro-
CAS Number:
122757-52-2
Molecular Formula:
C9H9FN2O4
Molecular Weight:
228.1772
IUPAC Name:
1-[(2R,5S)-3-fluoro-5-(hydroxymethyl)-2,5-dihydrofuran-2-yl]pyrimidine-2,4-dione
InChI:
InChI=1S/C9H9FN2O4/c10-6-3-5(4-13)16-8(6)12-2-1-7(14)11-9(12)15/h1-3,5,8,13H,4H2,(H,11,14,15)/t5-,8+/m0/s1
InChI Key:
SXIDSWOQTOLVOL-YLWLKBPMSA-N
SMILES:
OC[C@H]1O[C@H](C(=C1)F)n1ccc(=O)[nH]c1=O
Properties
Complexity:
393
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
2
Defined Bond Stereocenter Count:
0
Exact Mass:
228.055g/mol
Formal Charge:
0
Heavy Atom Count:
16
Hydrogen Bond Acceptor Count:
5
Hydrogen Bond Donor Count:
2
Isotope Atom Count:
0
Molecular Weight:
228.179g/mol
Monoisotopic Mass:
228.055g/mol
Rotatable Bond Count:
2
Topological Polar Surface Area:
78.9A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
-1.3
Literature
| Title | Journal |
|---|---|
| Synthesis and antiviral activity of monofluoro and difluoro analogues of pyrimidine deoxyribonucleosides against human immunodeficiency virus (HIV-1). | Journal of medicinal chemistry 19900801 |
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