Home Other Building Blocks ((2R,5S)-5-(4-Amino-5-fluoro-2-oxopyrimidin-1(2H)-yl)-1,3-oxathiolan-2-yl)methyl butyrate

((2R,5S)-5-(4-Amino-5-fluoro-2-oxopyrimidin-1(2H)-yl)-1,3-oxathiolan-2-yl)methyl butyrate

CAS No.:
143491-56-9
Catalog Number:
AG019ELV
Molecular Formula:
C12H16FN3O4S
Molecular Weight:
317.3365
Pack Size
Purity
Availability
Location
Price(USD)
Quantity
  
100mg
95%
In Stock USA
United States
$252
- +
250mg
95%
In Stock USA
United States
$462
- +
1g
95%
In Stock USA
United States
$945
- +
5g
95%
In Stock USA
United States
$2835
- +
Product Description
Catalog Number:
AG019ELV
Chemical Name:
((2R,5S)-5-(4-Amino-5-fluoro-2-oxopyrimidin-1(2H)-yl)-1,3-oxathiolan-2-yl)methyl butyrate
CAS Number:
143491-56-9
Molecular Formula:
C12H16FN3O4S
Molecular Weight:
317.3365
MDL Number:
MFCD30185762
IUPAC Name:
[(2R,5S)-5-(4-amino-5-fluoro-2-oxopyrimidin-1-yl)-1,3-oxathiolan-2-yl]methyl butanoate
InChI:
InChI=1S/C12H16FN3O4S/c1-2-3-9(17)19-5-10-20-8(6-21-10)16-4-7(13)11(14)15-12(16)18/h4,8,10H,2-3,5-6H2,1H3,(H2,14,15,18)/t8-,10+/m0/s1
InChI Key:
DQXKOXQEQONOBG-WCBMZHEXSA-N
SMILES:
CCCC(=O)OC[C@H]1SC[C@H](O1)n1cc(F)c(=N)[nH]c1=O
Properties
Complexity:
497  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
2  
Defined Bond Stereocenter Count:
0
Exact Mass:
317.085g/mol
Formal Charge:
0
Heavy Atom Count:
21  
Hydrogen Bond Acceptor Count:
6  
Hydrogen Bond Donor Count:
1  
Isotope Atom Count:
0
Molecular Weight:
317.335g/mol
Monoisotopic Mass:
317.085g/mol
Rotatable Bond Count:
6  
Topological Polar Surface Area:
120A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
0.5  
Properties