chempirical

Dipyrithione

C10H8N2O2S2CAS 3696-28-4252.31 g/mol

Open in Covalent MOL file
O−N+SSN+O−
Disulfide

Properties

Molecular formula
C10H8N2O2S2
Molar mass
252.31 g/mol
Exact mass
252.0027 Da
Melting point
205 °C
logP
1.75Crippen estimate
Polar surface area
53.9 Ų
H-bond donors / acceptors
0 / 4
Rotatable bonds
3

Identifiers

CAS number
3696-28-4
SMILES
[O-][n+]1ccccc1SSc1cccc[n+]1[O-]
InChIKey
ZHDBTKPXEJDTTQ-UHFFFAOYSA-N
InChI
InChI=1S/C10H8N2O2S2/c13-11-7-3-1-5-9(11)15-16-10-6-2-4-8-12(10)14/h1-8H

Weigh it out

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

Names and synonyms

27 names · show all
  • Pyridine, 2,2′-dithiobis-, 1,1′-dioxide
  • Pyridine, 2,2′-dithiodi-, 1,1′-dioxide
  • Bis(2-pyridyl) disulfide di-N-oxide
  • 2,2′-Dithiodipyridine 1,1′-dioxide
  • Bis(2-pyridyl-N-oxide) disulfide
  • 2,2′-Dithiobispyridine 1,1′-dioxide
  • Bis(N-oxido-2-pyridyl) disulfide
  • Bis(2-pyridyl 1-oxide) disulfide
  • 2,2′-Dithiobis(pyridine 1-oxide)
  • Bis(2-pyridine-N-oxide)disulfide
  • 2,2′-Dithiobis(pyridine N-oxide)
  • Omadine disulfide
  • (1-Oxo-2-pyridyl) disulfide
  • OSY 20
  • Omadine DS
  • Di-2-pyridyl disulfide N,N′-dioxide
  • NSC 677437
  • 2,2′-Dipyridyl disulfide bis-N-oxide
  • 2,2′-Dipyridyl disulfide N,N′-bisoxide
  • OMDS
  • NSC 241716
  • NSC 84740
  • Pyrion disulfide
  • Pyrithione disulfide
  • Bispyrithione
  • Sentex TBS
  • 1-Oxido-2-[(1-oxidopyridin-1-ium-2-yl)disulfanyl]pyridin-1-ium

Work with Dipyrithione

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

S-(2-Pyridyl)isothiuronium N-oxide hydrochloride2770-93-649 % similar 2-Mercaptopyridine N-oxide1121-31-948 % similar 2-Hydroxypyridine N-oxide13161-30-348 % similar 2-Chloropyridine N-oxide2402-95-148 % similar 2-Methylpyridine 1-oxide931-19-148 % similar 2-Chloropyridine N-oxide hydrochloride20295-64-143 % similar Sodium pyrithione3811-73-243 % similar 2-Bromopyridine N-oxide hydrochloride80866-91-743 % similar

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

Elsewhere

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