chempirical

Acyclovir sodium

C8H10N5NaO3CAS 69657-51-8247.19 g/mol

Open in Covalent MOL file
NHNO−NNOOHNHNa+
AlcoholEtherPhenol

Properties

Molecular formula
C8H10N5NaO3
Molar mass
247.19 g/mol
Exact mass
247.0681 Da
logP
-1.47Crippen estimate
Polar surface area
120.0 Ų
H-bond donors / acceptors
4 / 6
Rotatable bonds
4

Identifiers

CAS number
69657-51-8
SMILES
N=c1nc([O-])c2ncn(COCCO)c2[nH]1.[Na+]
InChIKey
BVOILEATUWMBTI-UHFFFAOYSA-N
InChI
InChI=1S/C8H11N5O3.Na/c9-8-11-6-5(7(15)12-8)10-3-13(6)4-16-2-1-14;/h3,14H,1-2,4H2,(H3,9,11,12,15);

Weigh it out

Type any one amount. The others follow from the molar mass.

Names and synonyms

5 names
  • 6H-Purin-6-one, 2-amino-1,9-dihydro-9-[(2-hydroxyethoxy)methyl]-, sodium salt (1:1)
  • 6H-Purin-6-one, 2-amino-1,9-dihydro-9-[(2-hydroxyethoxy)methyl]-, monosodium salt
  • Acycloguanosine sodium
  • Sodium acyclovir
  • Acyclovir sodium salt

Work with Acyclovir sodium

Predict the NMR spectrum1H and 13C shifts with multiplicities Make a solutionWhat to weigh for any molarity and volume Check drug-likenessLipinski, Veber and lead-likeness Isotope patternExact mass and the mass spectrum pattern

Similar compounds

Acyclovir59277-89-369 % similar Ganciclovir sodium107910-75-869 % similar Ganciclovir82410-32-045 % similar Valacyclovir124832-26-442 % similar Valacyclovir hydrochloride124832-27-540 % similar Penciclovir39809-25-139 % similar 9-[[2-(Acetyloxy)-1-(hydroxymethyl)ethoxy]methyl]-2-amino-1,9-dihydro-6H-purin-6-one88110-89-837 % similar N-[(Phenylmethoxy)carbonyl]-L-valine 2-[(2-amino-1,6-dihydro-6-oxo-9H-purin-9-yl)methoxy]ethyl ester124832-31-136 % similar

Tanimoto similarity of circular fingerprints over the whole catalogue. All similar compounds

Elsewhere

PubChem CAS Common Chemistry NIST WebBook