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1649427-38-2 | Uridine, 2'-deoxy-2'-fluoro-2'-methyl-, 3',5'-diacetate, (2'R)-
CAS No: 1649427-38-2 Catalog No: AG001V6H MDL No:
Product Description
Catalog Number:
AG001V6H
Chemical Name:
Uridine, 2'-deoxy-2'-fluoro-2'-methyl-, 3',5'-diacetate, (2'R)-
CAS Number:
1649427-38-2
Molecular Formula:
C14H17FN2O7
Molecular Weight:
344.2924
IUPAC Name:
[(2R,3R,4R,5R)-3-acetyloxy-5-(2,4-dioxopyrimidin-1-yl)-4-fluoro-4-methyloxolan-2-yl]methyl acetate
InChI:
InChI=1S/C14H17FN2O7/c1-7(18)22-6-9-11(23-8(2)19)14(3,15)12(24-9)17-5-4-10(20)16-13(17)21/h4-5,9,11-12H,6H2,1-3H3,(H,16,20,21)/t9-,11-,12-,14-/m1/s1
InChI Key:
BZKIFHNTGXSASD-XIDUGBJDSA-N
SMILES:
CC(=O)O[C@@H]1[C@@H](COC(=O)C)O[C@H]([C@]1(C)F)n1ccc(=O)[nH]c1=O
Properties
Complexity:
608
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
4
Defined Bond Stereocenter Count:
0
Exact Mass:
344.102g/mol
Formal Charge:
0
Heavy Atom Count:
24
Hydrogen Bond Acceptor Count:
8
Hydrogen Bond Donor Count:
1
Isotope Atom Count:
0
Molecular Weight:
344.295g/mol
Monoisotopic Mass:
344.102g/mol
Rotatable Bond Count:
6
Topological Polar Surface Area:
111A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
-0.5
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