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115913-78-5 | Cytidine, 3'-azido-2',3'-dideoxy-N-methyl- (9CI)
CAS No: 115913-78-5 Catalog No: AG000H3G MDL No:
Product Description
Catalog Number:
AG000H3G
Chemical Name:
Cytidine, 3'-azido-2',3'-dideoxy-N-methyl- (9CI)
CAS Number:
115913-78-5
Molecular Formula:
C10H14N6O3
Molecular Weight:
266.2566
IUPAC Name:
1-[(2R,4S,5S)-4-azido-5-(hydroxymethyl)oxolan-2-yl]-4-(methylamino)pyrimidin-2-one
InChI:
InChI=1S/C10H14N6O3/c1-12-8-2-3-16(10(18)13-8)9-4-6(14-15-11)7(5-17)19-9/h2-3,6-7,9,17H,4-5H2,1H3,(H,12,13,18)/t6-,7+,9+/m0/s1
InChI Key:
UWWRTDIZTFXDNX-LKEWCRSYSA-N
SMILES:
OC[C@H]1O[C@H](C[C@@H]1N=[N+]=[N-])n1ccc(nc1=O)NC
Properties
Complexity:
470
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
3
Defined Bond Stereocenter Count:
0
Exact Mass:
266.113g/mol
Formal Charge:
0
Heavy Atom Count:
19
Hydrogen Bond Acceptor Count:
5
Hydrogen Bond Donor Count:
2
Isotope Atom Count:
0
Molecular Weight:
266.261g/mol
Monoisotopic Mass:
266.113g/mol
Rotatable Bond Count:
4
Topological Polar Surface Area:
88.5A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
-0.2
Literature
| Title | Journal |
|---|---|
| Synthesis and anti-HIV activity of different sugar-modified pyrimidine and purine nucleosides. | Journal of medicinal chemistry 19881001 |
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