ChemSpider 2D Image | PIK-108 | C22H24N2O3

PIK-108

  • Molecular FormulaC22H24N2O3
  • Average mass364.438 Da
  • Monoisotopic mass364.178680 Da
  • ChemSpider ID26328424
  • defined stereocentres - 1 of 1 defined stereocentres


More details:






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

4H-1-Benzopyran-4-one, 6-methyl-2-(4-morpholinyl)-8-[(1S)-1-(phenylamino)ethyl]- [ACD/Index Name]
8-[(1S)-1-Anilinoethyl]-6-methyl-2-(4-morpholinyl)-4H-chromen-4-on [German] [ACD/IUPAC Name]
8-[(1S)-1-Anilinoethyl]-6-methyl-2-(4-morpholinyl)-4H-chromen-4-one [ACD/IUPAC Name]
8-[(1S)-1-Anilinoéthyl]-6-méthyl-2-(4-morpholinyl)-4H-chromén-4-one [French] [ACD/IUPAC Name]
PIK-108
8-[(1S)-1-anilinoethyl]-6-methyl-2-morpholin-4-ylchromen-4-one
901398-68-3 [RN]
P08

Predicted data is generated using the ACD/Labs Percepta Platform - PhysChem Module

Density: 1.3±0.1 g/cm3
Boiling Point: 545.6±50.0 °C at 760 mmHg
Vapour Pressure: 0.0±1.5 mmHg at 25°C
Enthalpy of Vaporization: 82.4±3.0 kJ/mol
Flash Point: 283.8±30.1 °C
Index of Refraction: 1.641
Molar Refractivity: 105.0±0.3 cm3
#H bond acceptors: 5
#H bond donors: 1
#Freely Rotating Bonds: 4
#Rule of 5 Violations: 0
ACD/LogP: 3.78
ACD/LogD (pH 5.5): 3.37
ACD/BCF (pH 5.5): 211.93
ACD/KOC (pH 5.5): 1585.42
ACD/LogD (pH 7.4): 3.39
ACD/BCF (pH 7.4): 223.34
ACD/KOC (pH 7.4): 1670.73
Polar Surface Area: 51 Å2
Polarizability: 41.6±0.5 10-24cm3
Surface Tension: 56.0±3.0 dyne/cm
Molar Volume: 291.0±3.0 cm3

Click to predict properties on the Chemicalize site






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