chempirical

Ranolazine

C24H33N3O4CAS 95635-55-5427.55 g/mol

Open in Covalent MOL file
OOOHNNONH
AlcoholEtherTertiary amine

Properties

Molecular formula
C24H33N3O4
Molar mass
427.55 g/mol
Exact mass
427.2471 Da
logP
2.96Crippen estimate
Polar surface area
77.8 Ų
H-bond donors / acceptors
2 / 6
Rotatable bonds
9

Identifiers

CAS number
95635-55-5
SMILES
COc1ccccc1OCC(O)CN1CCN(CC(O)=Nc2c(C)cccc2C)CC1
InChIKey
XKLMZUWKNUAPSZ-UHFFFAOYSA-N
InChI
InChI=1S/C24H33N3O4/c1-18-7-6-8-19(2)24(18)25-23(29)16-27-13-11-26(12-14-27)15-20(28)17-31-22-10-5-4-9-21(22)30-3/h4-10,20,28H,11-17H2,1-3H3,(H,25,29)

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Names and synonyms

9 names
  • 1-Piperazineacetamide, N-(2,6-dimethylphenyl)-4-[2-hydroxy-3-(2-methoxyphenoxy)propyl]-
  • 1-Piperazineacetamide, N-(2,6-dimethylphenyl)-4-[2-hydroxy-3-(2-methoxyphenoxy)propyl]-, (±)-
  • N-(2,6-Dimethylphenyl)-4-[2-hydroxy-3-(2-methoxyphenoxy)propyl]-1-piperazineacetamide
  • (±)-Ranolazine
  • CVT 303
  • Ranexa
  • RS 43285-003
  • Renexa
  • 4-(Pyrimidin-2-ylmethyl)-7-(4-(trifluoromethyl)phenyl)-3,4-dihydrobenzo[f][1,4]oxazepin-5(2H)-one

Work with Ranolazine

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

Ranolazine hydrochloride95635-56-694 % similar Naftopidil57149-07-249 % similar 4-[(2,6-Dimethylphenyl)aminocarbonylmethyl]piperazine5294-61-149 % similar Naftopidil dihydrochloride57149-08-347 % similar Lidocaine137-58-646 % similar Guaifenesin93-14-145 % similar Methocarbamol532-03-644 % similar Lidocaine hydrochloride73-78-944 % similar

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

Same formula

Ranolazine-D31054624-77-9

Elsewhere

PubChem CAS Common Chemistry NIST WebBook