chempirical

Vidarabine

C10H13N5O4CAS 5536-17-4267.25 g/mol

Open in Covalent MOL file
H2NNNNNOOHOHHO
AlcoholEtherPrimary amine

Properties

Molecular formula
C10H13N5O4
Molar mass
267.25 g/mol
Exact mass
267.0968 Da
Melting point
257–257.5 °C
Water solubility
< 1 g/L (21.1 °C)
logP
-1.98Crippen estimate
Polar surface area
139.5 Ų
H-bond donors / acceptors
4 / 8
Rotatable bonds
2
Stereocentres
R, R, S, Sin SMILES atom order

Hazards

Warning
Health Hazard (GHS08)

Aggregated from 41 ECHA notifications, via PubChem; a share says how many notifiers assign that statement.

Precautionary statements

P203, P280, P318, P405, P501

Identifiers

CAS number
5536-17-4
SMILES
Nc1ncnc2c1ncn2[C@@H]1O[C@H](CO)[C@@H](O)[C@@H]1O
InChIKey
OIRDTQYFTABQOQ-UHTZMRCNSA-N
InChI
InChI=1S/C10H13N5O4/c11-8-5-9(13-2-12-8)15(3-14-5)10-7(18)6(17)4(1-16)19-10/h2-4,6-7,10,16-18H,1H2,(H2,11,12,13)/t4-,6-,7+,10-/m1/s1

Weigh it out

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

Names and synonyms

26 names · show all
  • 9H-Purin-6-amine, 9-β-D-arabinofuranosyl-
  • Adenine, 9-β-D-arabinofuranosyl-
  • 9-β-D-Arabinofuranosyl-9H-purin-6-amine
  • Arabinosyladenine
  • 9-β-D-Arabinofuranosyladenine
  • Adenine arabinoside
  • β-D-Arabinosyladenine
  • 9-Arabinosyladenine
  • Ara-A
  • CI-673
  • Vidarabin
  • Adenine β-D-arabinofuranoside
  • NSC 404241
  • Araadenosine
  • Spongoadenosine
  • 9-β-D-Arabinoadenosine
  • 6-Amino-9-β-D-arabinofuranosylpurine
  • 9-β-D-Arabinosyladenine
  • Adenine 9-β-D-arabinofuranoside
  • β-D-Arabinofuranosyladenine
  • β-Ara-A
  • Vira-A
  • Arasena-A
  • Vidarabine anhydrous
  • NSC 247519
  • NQZ-071

Work with Vidarabine

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

Stereoisomers, salts and isotopologues

The same compound in another form: other stereochemistry, a salt or hydrate, the free acid or base, or an isotope-labelled version.

Adenosine58-61-7Diastereomer

Similar compounds

(2R,3R,4S,5R)-5-(6-Amino-9H-purin-9-yl)-4-fluoro-2-(hydroxymethyl)tetrahydrofuran-3-ol20227-41-279 % similar 2'-Fluoro-2'-deoxyadenosine64183-27-379 % similar 3'-Fluoro-3'-deoxyadenosine75059-22-279 % similar 3′-O-Methyladenosine10300-22-878 % similar 2′-O-Methyladenosine2140-79-678 % similar 5′-Chloro-5′-deoxyadenosine892-48-877 % similar Inosine58-63-974 % similar 6-Methylpurine riboside14675-48-073 % similar

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

Same formula

Azidothymidine30516-87-1 3'-Deoxyguanosine3608-58-0 2-Aminopurine riboside4546-54-7 Deoxyguanosine961-07-9

Elsewhere

PubChem CAS Common Chemistry NIST WebBook