ChemSpider 2D Image | 4-Amino-5-chloro-N-{(3S)-1-[3-(4-fluorophenoxy)propyl]-3-methoxy-4-piperidinyl}-2-[(~13~C)methyloxy]benzamide | C2213CH29ClFN3O4

4-Amino-5-chloro-N-{(3S)-1-[3-(4-fluorophenoxy)propyl]-3-methoxy-4-piperidinyl}-2-[(13C)methyloxy]benzamide

  • Molecular FormulaC2213CH29ClFN3O4
  • Average mass466.938 Da
  • Monoisotopic mass466.186432 Da
  • ChemSpider ID68026907

  • defined stereocentres - 1 of 2 defined stereocentres

    Non-standard isotope - Non-standard isotope

More details:

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

4-Amino-5-chlor-N-{(3S)-1-[3-(4-fluorphenoxy)propyl]-3-methoxy-4-piperidinyl}-2-[(13C)methyloxy]benzamid [German] [ACD/IUPAC Name]
4-Amino-5-chloro-N-{(3S)-1-[3-(4-fluorophenoxy)propyl]-3-methoxy-4-piperidinyl}-2-[(13C)methyloxy]benzamide [ACD/IUPAC Name]
4-Amino-5-chloro-N-{(3S)-1-[3-(4-fluorophénoxy)propyl]-3-méthoxy-4-pipéridinyl}-2-[(13C)méthyloxy]benzamide [French] [ACD/IUPAC Name]
Benzamide, 4-amino-5-chloro-N-[(3S)-1-[3-(4-fluorophenoxy)propyl]-3-methoxy-4-piperidinyl]-2-(methyl-13C-oxy)- [ACD/Index Name]
Cisapride-13C,d3

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

Density: 1.3±0.1 g/cm3
Boiling Point:
Vapour Pressure:
Enthalpy of Vaporization:
Flash Point:
Index of Refraction: 1.593
Molar Refractivity: 121.7±0.4 cm3
#H bond acceptors:
#H bond donors:
#Freely Rotating Bonds:
#Rule of 5 Violations:
ACD/LogP:
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:
Polarizability: 48.3±0.5 10-24cm3
Surface Tension: 54.6±5.0 dyne/cm
Molar Volume: 359.1±5.0 cm3

Click to predict properties on the Chemicalize site


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