Chemical Properties of Ajmaline (CAS 4360-12-7)

Ajmaline

InChI
InChI=1S/C20H26N2O2/c1-3-10-11-8-14-17-20(12-6-4-5-7-13(12)21(17)2)9-15(16(11)18(20)23)22(14)19(10)24/h4-7,10-11,14-19,23-24H,3,8-9H2,1-2H3/t10?,11?,14?,15?,16?,17?,18-,19+,20?/m1/s1
InChI Key
CJDRUOGAGYHKKD-UDPQVXKSSA-N
Formula
C20H26N2O2
SMILES
CCC1C2CC3C4N(C)c5ccccc5C45CC(C2C5O)N3C1O
Molecular Weight1
326.43
CAS
4360-12-7
Other Names
  • (+)-Ajmaline
  • 5H-6,10:11,12a-Dimethanoindolo[3,2-b]quinolizine, ajmalan-17,21-diol deriv.
  • Ajmalan-17,21-diol, (17R,21.alpha.)-
  • Ajmalan-17,21-diol, (17R,21«alpha»)-
  • Ajmalin
  • Aritmina
  • Cardiorythmine
  • Cartagine
  • Gilurytmal
  • Ignazin
  • Merabitol
  • NSC 15627
  • Raugalline
  • Rauwolfin
  • Rauwolfine
  • Rhytmaton
  • Ritmos
  • Rytmalin
  • Siddiqui
  • Tachmalin
  • Tajmalin
  • Takhmalin
  • Takycor
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Physical Properties

Property Value Unit Source
log10WS -2.82 Aq. Solubility Prediction
logPoct/wat 1.555 Crippen Calculated Property
McVol 246.300 ml/mol McGowan Calculated Property

Cheméo can also estimate Normal Boiling Point Temperature, Normal melting (fusion) point, Critical Temperature, Critical Pressure, Critical Volume, Enthalpy of formation at standard conditions, Enthalpy of vaporization at standard conditions, Standard Gibbs free energy of formation, Acentric Factor, Ionization energy for this compound, but they fall outside the models' validated range, so they are not shown here. Open the prediction tool to compute them on demand.

Similar Compounds

Nalmefene. DIHYDROERGOTAMINE. Strychnine. Dehydrojaconine. ERGOTAMINE. DIHYDROERGOKRYPTINE. 3-O,6-O,N-Triacetylnormorphine. Xanthine riboside, TMS. Diacetylmorphine. 9H-Purine, 9-[2-deoxy-3-O-(trimethylsilyl)-«beta»-D-erythro-pentofuranosyl]-6-(trimethylsiloxy)-2-[(trimethylsilyl)amino]-, 5'-[bis(trimethylsilyl) phospate]. Ergocristine. Triazolo[4,5-d]pyrimidin-7-ol,3h-v-, 5-amino-3-(2',3'-o-isopropylidene-beta-d-ribofuranosyl)-, 5'-diphenyl phosphate (keto form). Crinan-11-ol, 1,2-didehydro-3-methoxy-, (3«beta»,5«alpha»,11R,13«beta»,19«alpha»)-. Benzylmorphine. OXYCOLCHICINE.

Find more compounds similar to Ajmaline.

Sources

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