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Home > Other Building Blocks > 114008-05-8
114008-05-8 | Uridine, 3'-azido-2',3'-dideoxy-5-propyl- (9CI)
CAS No: 114008-05-8 Catalog No: AG000AAT MDL No:
Product Description
Catalog Number:
AG000AAT
Chemical Name:
Uridine, 3'-azido-2',3'-dideoxy-5-propyl- (9CI)
CAS Number:
114008-05-8
Molecular Formula:
C12H17N5O4
Molecular Weight:
295.2945
IUPAC Name:
1-[(2R,4S,5S)-4-azido-5-(hydroxymethyl)oxolan-2-yl]-5-propylpyrimidine-2,4-dione
InChI:
InChI=1S/C12H17N5O4/c1-2-3-7-5-17(12(20)14-11(7)19)10-4-8(15-16-13)9(6-18)21-10/h5,8-10,18H,2-4,6H2,1H3,(H,14,19,20)/t8-,9+,10+/m0/s1
InChI Key:
BRFSKODPZOCAPF-IVZWLZJFSA-N
SMILES:
CCCc1cn([C@@H]2O[C@@H]([C@H](C2)N=[N+]=[N-])CO)c(=O)[nH]c1=O
Properties
Complexity:
514
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
3
Defined Bond Stereocenter Count:
0
Exact Mass:
295.128g/mol
Formal Charge:
0
Heavy Atom Count:
21
Hydrogen Bond Acceptor Count:
6
Hydrogen Bond Donor Count:
2
Isotope Atom Count:
0
Molecular Weight:
295.299g/mol
Monoisotopic Mass:
295.128g/mol
Rotatable Bond Count:
5
Topological Polar Surface Area:
93.2A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
1
Literature
| Title | Journal |
|---|---|
| Structure-activity relationships of pyrimidine nucleosides as antiviral agents for human immunodeficiency virus type 1 in peripheral blood mononuclear cells. | Journal of medicinal chemistry 19890301 |
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