ChemSpider 2D Image | (R)-alepride | C22H30ClN3O2

(R)-alepride

  • Molecular FormulaC22H30ClN3O2
  • Average mass403.945 Da
  • Monoisotopic mass403.202667 Da
  • ChemSpider ID52083840

  • defined stereocentres - 1 of 1 defined stereocentres

More details:

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

(R)-alepride
2-(Allyloxy)-4-amino-5-chlor-N-{1-[(1R)-3-cyclohexen-1-ylmethyl]-4-piperidinyl}benzamid [German] [ACD/IUPAC Name]
2-(Allyloxy)-4-amino-5-chloro-N-{1-[(1R)-3-cyclohexen-1-ylmethyl]-4-piperidinyl}benzamide [ACD/IUPAC Name]
2-(Allyloxy)-4-amino-5-chloro-N-{1-[(1R)-3-cyclohexén-1-ylméthyl]-4-pipéridinyl}benzamide [French] [ACD/IUPAC Name]
Benzamide, 4-amino-5-chloro-N-[1-[(1R)-3-cyclohexen-1-ylmethyl]-4-piperidinyl]-2-(2-propen-1-yloxy)- [ACD/Index Name]
ALEPRIDE, (R)-

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

F9OWS86XKV [DBID]
UNII:F9OWS86XKV [DBID]

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

Density: 1.2±0.1 g/cm3
Boiling Point: 541.7±50.0 °C at 760 mmHg
Vapour Pressure: 0.0±1.4 mmHg at 25°C
Enthalpy of Vaporization: 82.0±3.0 kJ/mol
Flash Point: 281.4±30.1 °C
Index of Refraction: 1.599
Molar Refractivity: 114.2±0.4 cm3
#H bond acceptors: 5
#H bond donors: 3
#Freely Rotating Bonds: 7
#Rule of 5 Violations: 0
ACD/LogP: 4.22
ACD/LogD (pH 5.5): 0.93
ACD/BCF (pH 5.5): 1.00
ACD/KOC (pH 5.5): 4.04
ACD/LogD (pH 7.4): 2.51
ACD/BCF (pH 7.4): 24.27
ACD/KOC (pH 7.4): 154.10
Polar Surface Area: 68 Å2
Polarizability: 45.3±0.5 10-24cm3
Surface Tension: 52.9±5.0 dyne/cm
Molar Volume: 334.5±5.0 cm3

Click to predict properties on the Chemicalize site


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