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86625-99-2 | 2-[(5-amino-2,4,9-triazabicyclo[4.3.0]nona-1,3,5,7-tetraen-9-yl)methoxy]ethanol
CAS No: 86625-99-2 Catalog No: AG004TYS MDL No:
Product Description
Catalog Number:
AG004TYS
Chemical Name:
2-[(5-amino-2,4,9-triazabicyclo[4.3.0]nona-1,3,5,7-tetraen-9-yl)methoxy]ethanol
CAS Number:
86625-99-2
Molecular Formula:
C9H12N4O2
Molecular Weight:
208.2172
IUPAC Name:
2-[(4-aminopyrrolo[2,3-d]pyrimidin-7-yl)methoxy]ethanol
InChI:
InChI=1S/C9H12N4O2/c10-8-7-1-2-13(6-15-4-3-14)9(7)12-5-11-8/h1-2,5,14H,3-4,6H2,(H2,10,11,12)
InChI Key:
MRFDOXAECUKAFK-UHFFFAOYSA-N
SMILES:
Nc1ncnc2c1ccn2COCCO
NSC Number:
339171
Properties
Complexity:
205
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
208.096g/mol
Formal Charge:
0
Heavy Atom Count:
15
Hydrogen Bond Acceptor Count:
5
Hydrogen Bond Donor Count:
2
Isotope Atom Count:
0
Molecular Weight:
208.221g/mol
Monoisotopic Mass:
208.096g/mol
Rotatable Bond Count:
4
Topological Polar Surface Area:
86.2A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
-0.5
Literature
| Title | Journal |
|---|---|
| Activity of acyclic halogenated tubercidin analogs against human cytomegalovirus and in uninfected cells. | Antiviral research 19910901 |
| Design, synthesis, and studies on the structure activity relationships of certain pyrrolo[2,3-d]pyrimidine nucleosides and structurally related analogs as potential antineoplastic and antiviral agents. | Farmaco (Societa chimica italiana : 1989) 19910101 |
| Synthesis, cytotoxicity, and antiviral activity of certain 7-[(2-hydroxyethoxy)methyl]pyrrolo[2,3-d]pyrimidine nucleosides related to toyocamycin and sangivamycin. | Journal of medicinal chemistry 19890701 |
| Synthesis and antiviral activity of certain 4-substituted and 2,4-disubstituted 7-[(2-hydroxyethoxy)methyl]pyrrolo[2,3-d]pyrimidines. | Journal of medicinal chemistry 19880801 |
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