chempirical

4-Hydroxy-2,5,6-triaminopyrimidine

C4H7N5OCAS 1004-75-7141.13 g/mol

Open in Covalent MOL file
HNNOHNH2NH2HN
PhenolPrimary amine

Properties

Molecular formula
C4H7N5O
Molar mass
141.13 g/mol
Exact mass
141.0651 Da
Melting point
242 °C (decomposes)
logP
-1.24Crippen estimate
Polar surface area
124.8 Ų
H-bond donors / acceptors
5 / 5
Rotatable bonds
0

Identifiers

CAS number
1004-75-7
SMILES
N=c1nc(O)c(N)c(N)[nH]1
InChIKey
SYEYEGBZVSWYPK-UHFFFAOYSA-N
InChI
InChI=1S/C4H7N5O/c5-1-2(6)8-4(7)9-3(1)10/h5H2,(H5,6,7,8,9,10)

Weigh it out

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

Names and synonyms

20 names · show all
  • 4(3H)-Pyrimidinone, 2,5,6-triamino-
  • 4(1H)-Pyrimidinone, 2,5,6-triamino-
  • 4-Pyrimidinol, 2,5,6-triamino-
  • 2,5,6-Triamino-4(3H)-pyrimidinone
  • 6-Hydroxy-2,4,5-triaminopyrimidine
  • 2,4,5-Triamino-6-hydroxypyrimidine
  • 2,5,6-Triamino-4-pyrimidinol
  • 2,4,5-Triaminopyrimidin-6(1H)-one
  • 2,4,5-Triamino-6-pyrimidinol
  • 2,5,6-Triamino-4-oxopyrimidine
  • 2,5,6-Triamino-4-pyrimidinone
  • 2,5,6-Triaminopyrimidin-4(3H)-one
  • 2,5,6-Triaminopyrimidin-4(1H)-one
  • 2,5,6-Triamino-4(1H)-pyrimidone
  • NSC 9313
  • 2,5,6-Triamino-4-hydroxypyrimidine
  • 2,5,6-Triamino-3,4-dihydro-4-pyrimidinone
  • 2,5,6-Triamino-1H-pyrimidin-4-one
  • 2,5,6-Triamino-1,4-dihydropyrimidin-4-one
  • 2,5,6-Triamino-3,4-dihydropyrimidin-4-one

Work with 4-Hydroxy-2,5,6-triaminopyrimidine

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

2,5,6-Triaminopyrimidin-4-ol sulfuric acid salt35011-47-376 % similar 2,5,6-Triamino-4-hydroxypyrimidine sulfate39267-74-876 % similar 2,5-Diamino-4,6-dihydroxypyrimidine40769-69-567 % similar 2,5-Diamino-4,6-dihydroxypyrimidine hydrochloride56830-58-161 % similar 2,6-Diamino-5-nitroso-4(3H)-pyrimidinone2387-48-657 % similar (Triaminopyrimidin-4-yl)oxidanesulfonic acid1603-02-748 % similar 2-Amino-5,6-dimethyl-4(3H)-pyrimidinone3977-23-944 % similar 8-Azaguanine134-58-741 % similar

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

Elsewhere

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