ChemSpider 2D Image | N-Allyl-4-butoxy-N-(2-{[2-(3,4-dimethoxyphenyl)ethyl][(3-methyl-2-thienyl)methyl]amino}-2-oxoethyl)benzamide | C32H40N2O5S

N-Allyl-4-butoxy-N-(2-{[2-(3,4-dimethoxyphenyl)ethyl][(3-methyl-2-thienyl)methyl]amino}-2-oxoethyl)benzamide

  • Molecular FormulaC32H40N2O5S
  • Average mass564.735 Da
  • Monoisotopic mass564.265808 Da
  • ChemSpider ID2890206

More details:

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

Benzamide, 4-butoxy-N-[2-[[2-(3,4-dimethoxyphenyl)ethyl][(3-methyl-2-thienyl)methyl]amino]-2-oxoethyl]-N-2-propen-1-yl- [ACD/Index Name]
N-Allyl-4-butoxy-N-(2-{[2-(3,4-dimethoxyphenyl)ethyl][(3-methyl-2-thienyl)methyl]amino}-2-oxoethyl)benzamid [German] [ACD/IUPAC Name]
N-Allyl-4-butoxy-N-(2-{[2-(3,4-dimethoxyphenyl)ethyl][(3-methyl-2-thienyl)methyl]amino}-2-oxoethyl)benzamide [ACD/IUPAC Name]
N-Allyl-4-butoxy-N-(2-{[2-(3,4-diméthoxyphényl)éthyl][(3-méthyl-2-thiényl)méthyl]amino}-2-oxoéthyl)benzamide [French] [ACD/IUPAC Name]

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

Density: 1.1±0.1 g/cm3
Boiling Point: 725.1±60.0 °C at 760 mmHg
Vapour Pressure: 0.0±2.4 mmHg at 25°C
Enthalpy of Vaporization: 105.9±3.0 kJ/mol
Flash Point: 392.4±32.9 °C
Index of Refraction: 1.573
Molar Refractivity: 162.0±0.3 cm3
#H bond acceptors: 7
#H bond donors: 0
#Freely Rotating Bonds: 16
#Rule of 5 Violations: 2
ACD/LogP: 6.65
ACD/LogD (pH 5.5): 5.72
ACD/BCF (pH 5.5): 13115.95
ACD/KOC (pH 5.5): 30839.62
ACD/LogD (pH 7.4): 5.72
ACD/BCF (pH 7.4): 13115.95
ACD/KOC (pH 7.4): 30839.62
Polar Surface Area: 97 Å2
Polarizability: 64.2±0.5 10-24cm3
Surface Tension: 44.5±3.0 dyne/cm
Molar Volume: 491.9±3.0 cm3

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