200,000+ products from a single source!
sales@angenechem.com
86629-59-6 | 1,3-Propanediol, 2-[(2,6-diamino-9H-purin-9-yl)methoxy]-
CAS No: 86629-59-6 Catalog No: AG004OZS MDL No:
Product Description
Catalog Number:
AG004OZS
Chemical Name:
1,3-Propanediol, 2-[(2,6-diamino-9H-purin-9-yl)methoxy]-
CAS Number:
86629-59-6
Molecular Formula:
C9H14N6O3
Molecular Weight:
254.2459
IUPAC Name:
2-[(2,6-diaminopurin-9-yl)methoxy]propane-1,3-diol
InChI:
InChI=1S/C9H14N6O3/c10-7-6-8(14-9(11)13-7)15(3-12-6)4-18-5(1-16)2-17/h3,5,16-17H,1-2,4H2,(H4,10,11,13,14)
InChI Key:
VRMNUBZQJCWRKA-UHFFFAOYSA-N
SMILES:
OCC(OCn1cnc2c1nc(N)nc2N)CO
Properties
Complexity:
267
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
254.113g/mol
Formal Charge:
0
Heavy Atom Count:
18
Hydrogen Bond Acceptor Count:
8
Hydrogen Bond Donor Count:
4
Isotope Atom Count:
0
Molecular Weight:
254.25g/mol
Monoisotopic Mass:
254.113g/mol
Rotatable Bond Count:
5
Topological Polar Surface Area:
145A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
-2.1
Literature
| Title | Journal |
|---|---|
| Acyclic analogues of 2'-deoxynucleosides related to 9-[(1,3-dihydroxy-2-propoxy)methyl]guanine as potential antiviral agents. | Journal of medicinal chemistry 19850301 |
Related Products
Featured Products
© 2019 Angene International Limited. All rights Reserved.