ChemSpider 2D Image | 4-{[1-(1-Amino-1-oxo-2-propanyl)-4-piperidinyl]oxy}-3-chloro-N-[2-(dimethylamino)ethyl]benzamide | C19H29ClN4O3

4-{[1-(1-Amino-1-oxo-2-propanyl)-4-piperidinyl]oxy}-3-chloro-N-[2-(dimethylamino)ethyl]benzamide

  • Molecular FormulaC19H29ClN4O3
  • Average mass396.912 Da
  • Monoisotopic mass396.192810 Da
  • ChemSpider ID30965401

More details:

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

1-Piperidineacetamide, 4-[2-chloro-4-[[[2-(dimethylamino)ethyl]amino]carbonyl]phenoxy]-α-methyl- [ACD/Index Name]
4-{[1-(1-Amino-1-oxo-2-propanyl)-4-piperidinyl]oxy}-3-chlor-N-[2-(dimethylamino)ethyl]benzamid [German] [ACD/IUPAC Name]
4-{[1-(1-Amino-1-oxo-2-propanyl)-4-piperidinyl]oxy}-3-chloro-N-[2-(dimethylamino)ethyl]benzamide [ACD/IUPAC Name]
4-{[1-(1-Amino-1-oxo-2-propanyl)-4-pipéridinyl]oxy}-3-chloro-N-[2-(diméthylamino)éthyl]benzamide [French] [ACD/IUPAC Name]
4-{[1-(1-CARBAMOYLETHYL)PIPERIDIN-4-YL]OXY}-3-CHLORO-N-[2-(DIMETHYLAMINO)ETHYL]BENZAMIDE
4-{[1-(2-amino-1-methyl-2-oxoethyl)piperidin-4-yl]oxy}-3-chloro-N-[2-(dimethylamino)ethyl]benzamide

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

Density: 1.2±0.1 g/cm3
Boiling Point: 568.3±50.0 °C at 760 mmHg
Vapour Pressure: 0.0±1.6 mmHg at 25°C
Enthalpy of Vaporization: 85.3±3.0 kJ/mol
Flash Point: 297.5±30.1 °C
Index of Refraction: 1.561
Molar Refractivity: 106.5±0.3 cm3
#H bond acceptors: 7
#H bond donors: 3
#Freely Rotating Bonds: 8
#Rule of 5 Violations: 0
ACD/LogP: 1.30
ACD/LogD (pH 5.5): -1.41
ACD/BCF (pH 5.5): 1.00
ACD/KOC (pH 5.5): 1.00
ACD/LogD (pH 7.4): 0.91
ACD/BCF (pH 7.4): 2.14
ACD/KOC (pH 7.4): 41.64
Polar Surface Area: 88 Å2
Polarizability: 42.2±0.5 10-24cm3
Surface Tension: 48.4±3.0 dyne/cm
Molar Volume: 329.0±3.0 cm3

Click to predict properties on the Chemicalize site


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