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139418-97-6 | Uridine, 4'-C-azido-5-chloro-2'-deoxy-
CAS No: 139418-97-6 Catalog No: AG001AZY MDL No:
Product Description
Catalog Number:
AG001AZY
Chemical Name:
Uridine, 4'-C-azido-5-chloro-2'-deoxy-
CAS Number:
139418-97-6
Molecular Formula:
C9H10ClN5O5
Molecular Weight:
303.6592
IUPAC Name:
1-[(2R,4S,5R)-5-azido-4-hydroxy-5-(hydroxymethyl)oxolan-2-yl]-5-chloropyrimidine-2,4-dione
InChI:
InChI=1S/C9H10ClN5O5/c10-4-2-15(8(19)12-7(4)18)6-1-5(17)9(3-16,20-6)13-14-11/h2,5-6,16-17H,1,3H2,(H,12,18,19)/t5-,6+,9+/m0/s1
InChI Key:
HOSVVXRRMIIWHJ-CCGCGBOQSA-N
SMILES:
[N-]=[N+]=N[C@]1(CO)O[C@H](C[C@@H]1O)n1cc(Cl)c(=O)[nH]c1=O
Properties
Complexity:
533
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
3
Defined Bond Stereocenter Count:
0
Exact Mass:
303.037g/mol
Formal Charge:
0
Heavy Atom Count:
20
Hydrogen Bond Acceptor Count:
7
Hydrogen Bond Donor Count:
3
Isotope Atom Count:
0
Molecular Weight:
303.659g/mol
Monoisotopic Mass:
303.037g/mol
Rotatable Bond Count:
3
Topological Polar Surface Area:
114A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
1
XLogP3:
0.3
Literature
| Title | Journal |
|---|---|
| Synthesis and anti-HIV activity of 4'-azido- and 4'-methoxynucleosides. | Journal of medicinal chemistry 19920417 |
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