chempirical

Robenidine hydrochloride

C15H14Cl3N5CAS 25875-50-7370.66 g/mol

Open in Covalent MOL file
HClNHHNNClNHNCl
Aryl halideGuanidineHydrazone

Properties

Molecular formula
C15H14Cl3N5
Molar mass
370.66 g/mol
Exact mass
369.0315 Da
Melting point
289–290 °C
logP
3.90Crippen estimate
Polar surface area
72.6 Ų
H-bond donors / acceptors
3 / 3
Rotatable bonds
4

Identifiers

CAS number
25875-50-7
SMILES
Cl.N=C(NN=Cc1ccc(Cl)cc1)NN=Cc1ccc(Cl)cc1
InChIKey
LTWIBTYLSRDGHP-UHFFFAOYSA-N
InChI
InChI=1S/C15H13Cl2N5.ClH/c16-13-5-1-11(2-6-13)9-19-21-15(18)22-20-10-12-3-7-14(17)8-4-12;/h1-10H,(H3,18,21,22);1H

Weigh it out

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

Names and synonyms

8 names
  • Carbonimidic dihydrazide, 2,2′-bis[(4-chlorophenyl)methylene]-, hydrochloride (1:1)
  • Guanidine, 1,3-bis[(p-chlorobenzylidene)amino]-, monohydrochloride
  • Carbonimidic dihydrazide, bis[(4-chlorophenyl)methylene]-, monohydrochloride
  • Robenzidene
  • 1,3-Bis[(p-chlorobenzylidene)amino]guanidine monohydrochloride
  • Cycostat
  • NCL 812
  • 2,2′-Bis[(4-chlorophenyl)methylene]carbonimidic dihydrazide hydrochloride

Work with Robenidine hydrochloride

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

Robenidine25875-51-890 % similar Chlorhexidine hydrochloride3697-42-541 % similar 1-(p-Chlorophenyl)biguanide monohydrochloride4022-81-541 % similar 4-Chlorobenzamidine hydrochloride14401-51-538 % similar Chlorhexidine55-56-135 % similar 4′-Formylacetanilide thiosemicarbazone104-06-335 % similar 4-Chlorobenzaldehyde104-88-133 % similar 4-Chloroaniline hydrochloride20265-96-733 % similar

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

Elsewhere

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