ChemSpider 2D Image | [(3R)-3-Cyclohexyl-2,3-dihydro[1,4]oxazino[2,3,4-hi]indol-6-yl][(3S)-3,4-dimethyl-1-piperazinyl]methanone | C23H31N3O2

[(3R)-3-Cyclohexyl-2,3-dihydro[1,4]oxazino[2,3,4-hi]indol-6-yl][(3S)-3,4-dimethyl-1-piperazinyl]methanone

  • Molecular FormulaC23H31N3O2
  • Average mass381.511 Da
  • Monoisotopic mass381.241638 Da
  • ChemSpider ID25030634

  • defined stereocentres - 2 of 2 defined stereocentres

More details:

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

[(3R)-3-Cyclohexyl-2,3-dihydro[1,4]oxazino[2,3,4-hi]indol-6-yl][(3S)-3,4-dimethyl-1-piperazinyl]methanon [German] [ACD/IUPAC Name]
[(3R)-3-Cyclohexyl-2,3-dihydro[1,4]oxazino[2,3,4-hi]indol-6-yl][(3S)-3,4-dimethyl-1-piperazinyl]methanone [ACD/IUPAC Name]
[(3R)-3-Cyclohexyl-2,3-dihydro[1,4]oxazino[2,3,4-hi]indol-6-yl][(3S)-3,4-diméthyl-1-pipérazinyl]méthanone [French] [ACD/IUPAC Name]
Methanone, [(3R)-3-cyclohexyl-2,3-dihydro-1,4-oxazino[2,3,4-hi]indol-6-yl][(3S)-3,4-dimethyl-1-piperazinyl]- [ACD/Index Name]

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

Density: 1.3±0.1 g/cm3
Boiling Point: 566.0±50.0 °C at 760 mmHg
Vapour Pressure: 0.0±1.5 mmHg at 25°C
Enthalpy of Vaporization: 85.0±3.0 kJ/mol
Flash Point: 296.1±30.1 °C
Index of Refraction: 1.666
Molar Refractivity: 109.5±0.5 cm3
#H bond acceptors: 5
#H bond donors: 0
#Freely Rotating Bonds: 2
#Rule of 5 Violations: 0
ACD/LogP: 3.35
ACD/LogD (pH 5.5): 1.66
ACD/BCF (pH 5.5): 4.13
ACD/KOC (pH 5.5): 30.82
ACD/LogD (pH 7.4): 3.17
ACD/BCF (pH 7.4): 132.51
ACD/KOC (pH 7.4): 988.17
Polar Surface Area: 38 Å2
Polarizability: 43.4±0.5 10-24cm3
Surface Tension: 49.3±7.0 dyne/cm
Molar Volume: 294.5±7.0 cm3

Click to predict properties on the Chemicalize site


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