ChemSpider 2D Image | (2S)-2-Hydroxy-N-[(6aS)-11-hydroxy-3,6a-dimethyl-9-oxo-6a,9-dihydropyrrolo[1,2-i][1,7]phenanthrolin-12-yl]propanamide | C20H19N3O4

(2S)-2-Hydroxy-N-[(6aS)-11-hydroxy-3,6a-dimethyl-9-oxo-6a,9-dihydropyrrolo[1,2-i][1,7]phenanthrolin-12-yl]propanamide

  • Molecular FormulaC20H19N3O4
  • Average mass365.383 Da
  • Monoisotopic mass365.137543 Da
  • ChemSpider ID35517096

  • defined stereocentres - 2 of 2 defined stereocentres

More details:

Validated by Experts, Validated by Users, Non-Validated, Removed by Users

(2S)-2-Hydroxy-N-[(6aS)-11-hydroxy-3,6a-dimethyl-9-oxo-6a,9-dihydropyrrolo[1,2-i][1,7]phenanthrolin-12-yl]propanamid [German] [ACD/IUPAC Name]
(2S)-2-Hydroxy-N-[(6aS)-11-hydroxy-3,6a-dimethyl-9-oxo-6a,9-dihydropyrrolo[1,2-i][1,7]phenanthrolin-12-yl]propanamide [ACD/IUPAC Name]
(2S)-2-Hydroxy-N-[(6aS)-11-hydroxy-3,6a-diméthyl-9-oxo-6a,9-dihydropyrrolo[1,2-i][1,7]phénanthrolin-12-yl]propanamide [French] [ACD/IUPAC Name]
Propanamide, N-[(6aS)-6a,9-dihydro-11-hydroxy-3,6a-dimethyl-9-oxopyrrolo[1,2-i][1,7]phenanthrolin-12-yl]-2-hydroxy-, (2S)- [ACD/Index Name]

Predicted data is generated using the ACD/Labs Percepta Platform - PhysChem Module, version: 14.00

Density: 1.5±0.1 g/cm3
Boiling Point: 610.0±55.0 °C at 760 mmHg
Vapour Pressure: 0.0±1.8 mmHg at 25°C
Enthalpy of Vaporization: 95.3±3.0 kJ/mol
Flash Point: 322.7±31.5 °C
Index of Refraction: 1.738
Molar Refractivity: 99.6±0.4 cm3
#H bond acceptors: 7
#H bond donors: 3
#Freely Rotating Bonds: 2
#Rule of 5 Violations: 0
ACD/LogP: 1.60
ACD/LogD (pH 5.5):
ACD/BCF (pH 5.5):
ACD/KOC (pH 5.5):
ACD/LogD (pH 7.4):
ACD/BCF (pH 7.4):
ACD/KOC (pH 7.4):
Polar Surface Area: 103 Å2
Polarizability: 39.5±0.5 10-24cm3
Surface Tension: 83.0±5.0 dyne/cm
Molar Volume: 247.5±5.0 cm3

Click to predict properties on the Chemicalize site


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