chempirical

Eslicarbazepine acetate

C17H16N2O3CAS 236395-14-5296.33 g/mol

Open in Covalent MOL file
OONNH2O
Ester

Properties

Molecular formula
C17H16N2O3
Molar mass
296.33 g/mol
Exact mass
296.1161 Da
Melting point
186–187 °C
logP
3.48Crippen estimate
Polar surface area
73.6 Ų
H-bond donors / acceptors
2 / 3
Rotatable bonds
1
Stereocentres
Sin SMILES atom order

Identifiers

CAS number
236395-14-5
SMILES
CC(=O)O[C@H]1Cc2ccccc2N(C(=N)O)c2ccccc21
InChIKey
QIALRBLEEWJACW-INIZCTEOSA-N
InChI
InChI=1S/C17H16N2O3/c1-11(20)22-16-10-12-6-2-4-8-14(12)19(17(18)21)15-9-5-3-7-13(15)16/h2-9,16H,10H2,1H3,(H2,18,21)/t16-/m0/s1

Weigh it out

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

Names and synonyms

12 names
  • 5H-Dibenz[b,f]azepine-5-carboxamide, 10-(acetyloxy)-10,11-dihydro-, (10S)-
  • (10S)-10-(Acetyloxy)-10,11-dihydro-5H-dibenz[b,f]azepine-5-carboxamide
  • BIA 2-093
  • (S)-(-)-10-Acetoxy-10,11-dihydro-5H-dibenz[b,f]azepine-5-carboxamide
  • (S)-10-Acetoxy-10,11-dihydro-5H-dibenz[b,f]azepine-5-carboxamide
  • Sep 0002093
  • Exelief
  • (S)-(-)-10-Acetoxy-10,11-dihydro-5H-dibenzo[b,f]azepine-5-carboxamide
  • Aptiom
  • (S)-5-Carbamoyl-10,11-dihydro-5H-dibenzo[b,f]azepin-10-yl acetate
  • Zebinix
  • Exalief

Work with Eslicarbazepine acetate

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

Eslicarbazepine104746-04-558 % similar Licarbazepine29331-92-858 % similar 10,11-Dihydrocarbamazepine3564-73-650 % similar Oxcarbazepine28721-07-546 % similar Carbamazepine298-46-437 % similar 1-Phenyl-2-propanol acetate2114-33-235 % similar (-)-O-Acetylmandelic acid51019-43-335 % similar O-Acetylmandelic acid5438-68-635 % similar

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

Same formula

4-[(6,7-Dimethoxyquinolin-4-yl)oxy]aniline190728-25-7 2-[(1,2-Dihydro-2-oxo-3H-indol-3-ylidene)methyl]-4-methyl-1H-pyrrole-3-propanoic acid215543-92-3

Elsewhere

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