chempirical

Diuretamidine sulfate

C2H8N4O5SCAS 591-01-5200.17 g/mol

Open in Covalent MOL file
NHH2NNHNH2OOSOHOOH
Guanidine

Properties

Molecular formula
C2H8N4O5S
Molar mass
200.17 g/mol
Exact mass
200.0215 Da
logP
-1.69Crippen estimate
Polar surface area
180.6 Ų
H-bond donors / acceptors
7 / 4
Rotatable bonds
0

Identifiers

CAS number
591-01-5
SMILES
N=C(N)NC(=N)O.O=S(=O)(O)O
InChIKey
SQRSGVMGWSKZTQ-UHFFFAOYSA-N
InChI
InChI=1S/C2H6N4O.H2O4S/c3-1(4)6-2(5)7;1-5(2,3)4/h(H6,3,4,5,6,7);(H2,1,2,3,4)

Weigh it out

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

Names and synonyms

6 names
  • Urea, N-(aminoiminomethyl)-, sulfate (2:1)
  • Urea, amidino-, sulfate (2:1)
  • Urea, (aminoiminomethyl)-, sulfate (2:1)
  • Carbamylguanidine sulfate
  • Dicyanodiamidine sulfate
  • Guanylurea sulfate

Work with Diuretamidine sulfate

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

Guanylurea phosphate17675-60-459 % similar Aminoguanidine sulfate1068-42-458 % similar Aminoguanidine hemisulfate996-19-058 % similar 1,4-Diguanidinobutane sulfate14923-17-258 % similar Agmatine sulfate2482-00-050 % similar Carbamidinium sulfate1184-68-547 % similar Guanidinium sulfate594-14-947 % similar Guanethidine monosulfate645-43-244 % similar

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

Elsewhere

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