chempirical

Moxonidine

C9H12ClN5OCAS 75438-57-2241.68 g/mol

Open in Covalent MOL file
ONNClNHNNH
Aryl halideEtherGuanidine

Properties

Molecular formula
C9H12ClN5O
Molar mass
241.68 g/mol
Exact mass
241.0730 Da
Melting point
217–219 °C (decomposes)
logP
0.82Crippen estimate
Polar surface area
71.4 Ų
H-bond donors / acceptors
2 / 6
Rotatable bonds
2

Identifiers

CAS number
75438-57-2
SMILES
COc1nc(C)nc(Cl)c1NC1=NCCN1
InChIKey
WPNJAUFVNXKLIM-UHFFFAOYSA-N
InChI
InChI=1S/C9H12ClN5O/c1-5-13-7(10)6(8(14-5)16-2)15-9-11-3-4-12-9/h3-4H2,1-2H3,(H2,11,12,15)

Weigh it out

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

Names and synonyms

15 names · show all
  • 5-Pyrimidinamine, 4-chloro-N-(4,5-dihydro-1H-imidazol-2-yl)-6-methoxy-2-methyl-
  • 4-Chloro-N-(4,5-dihydro-1H-imidazol-2-yl)-6-methoxy-2-methyl-5-pyrimidinamine
  • BE 5895
  • BDF 5895
  • 2-(6-Chloro-4-methoxy-2-methylpyrimidin-5-ylamino)-2-imidazoline
  • Cynt
  • Lomox
  • Moxon
  • Normoxocin
  • Physiotens
  • LY 326869
  • Nucynt
  • Norcynt
  • Moxogamma
  • (4-Chloro-6-methoxy-2-methyl-pyrimidin-5-yl)-imidazolidin-2-ylidene-amine

Work with Moxonidine

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

Clonidine4205-90-742 % similar Clonidine hydrochloride4205-91-839 % similar Apraclonidine66711-21-538 % similar Apraclonidine hydrochloride73218-79-836 % similar Tizanidine51322-75-936 % similar Tizanidine hydrochloride64461-82-134 % similar

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

Elsewhere

PubChem CAS Common Chemistry NIST WebBook