Name: Name:6H-Purin-6-one, 9-[[2-(acetyloxy)ethoxy]methyl]-2-amino-1,9-dihydro-
Brand: Angene
SKU: AG000885
Rating: 90 (10 reviews)

6H-Purin-6-one, 9-[[2-(acetyloxy)ethoxy]methyl]-2-amino-1,9-dihydro-

CAS No.:

102728-64-3

Catalog Number:

AG000885

Molecular Formula:

C10H13N5O4

Molecular Weight:

267.2413

Pack Size

Purity

Availability

Location

Price(USD)

Quantity

Product Description

Catalog Number:

AG000885

Chemical Name:

6H-Purin-6-one, 9-[[2-(acetyloxy)ethoxy]methyl]-2-amino-1,9-dihydro-

CAS Number:

102728-64-3

Molecular Formula:

C10H13N5O4

Molecular Weight:

267.2413

MDL Number:

MFCD00871663

IUPAC Name:

2-[(2-amino-6-oxo-1H-purin-9-yl)methoxy]ethyl acetate

InChI:

InChI=1S/C10H13N5O4/c1-6(16)19-3-2-18-5-15-4-12-7-8(15)13-10(11)14-9(7)17/h4H,2-3,5H2,1H3,(H3,11,13,14,17)

InChI Key:

DMHAXLGAKQREIL-UHFFFAOYSA-N

SMILES:

CC(=O)OCCOCn1cnc2c1nc(N)[nH]c2=O

UNII:

Y16CE349S3

Properties

Complexity:

399

Compound Is Canonicalized:

Yes

Covalently-Bonded Unit Count:

Defined Atom Stereocenter Count:

Defined Bond Stereocenter Count:

Exact Mass:

267.097g/mol

Formal Charge:

Heavy Atom Count:

Hydrogen Bond Acceptor Count:

Hydrogen Bond Donor Count:

Isotope Atom Count:

Molecular Weight:

267.245g/mol

Monoisotopic Mass:

267.097g/mol

Rotatable Bond Count:

Topological Polar Surface Area:

121A^2

Undefined Atom Stereocenter Count:

Undefined Bond Stereocenter Count:

XLogP3:

-1.3

Literature

Title	Journal
Synthesis and biological evaluation of iodinated and fluorinated 9-(2-hydroxypropyl) and 9-(2-hydroxyethoxy)methyl purine nucleoside analogues.	Journal of medicinal chemistry 20031218

Properties