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150021-19-5 | Uridine, 5-(1-azido-2-chloroethyl)-2'-deoxy-, (R)- (9CI)
CAS No: 150021-19-5 Catalog No: AG001M99 MDL No:
Product Description
Catalog Number:
AG001M99
Chemical Name:
Uridine, 5-(1-azido-2-chloroethyl)-2'-deoxy-, (R)- (9CI)
CAS Number:
150021-19-5
Molecular Formula:
C11H14ClN5O5
Molecular Weight:
331.7124
IUPAC Name:
5-[(1R)-1-azido-2-chloroethyl]-1-[(2R,4S,5R)-4-hydroxy-5-(hydroxymethyl)oxolan-2-yl]pyrimidine-2,4-dione
InChI:
InChI=1S/C11H14ClN5O5/c12-2-6(15-16-13)5-3-17(11(21)14-10(5)20)9-1-7(19)8(4-18)22-9/h3,6-9,18-19H,1-2,4H2,(H,14,20,21)/t6-,7-,8+,9+/m0/s1
InChI Key:
UCPSBDUPEGUDEU-RBXMUDONSA-N
SMILES:
ClCC(c1cn([C@H]2C[C@@H]([C@H](O2)CO)O)c(=O)[nH]c1=O)N=[N+]=[N-]
Properties
Complexity:
549
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
4
Defined Bond Stereocenter Count:
0
Exact Mass:
331.068g/mol
Formal Charge:
0
Heavy Atom Count:
22
Hydrogen Bond Acceptor Count:
7
Hydrogen Bond Donor Count:
3
Isotope Atom Count:
0
Molecular Weight:
331.713g/mol
Monoisotopic Mass:
331.068g/mol
Rotatable Bond Count:
5
Topological Polar Surface Area:
114A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
0
Literature
| Title | Journal |
|---|---|
| Synthesis and antiviral activity of novel 5-(1-azido-2-haloethyl) and 5-(1-azido-, amino-, or methoxyethyl) analogs of 2'-deoxyuridine. | Journal of medicinal chemistry 19930820 |
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