ChemSpider 2D Image | N-Cyclopropyl-N-(2-{[2-(3,4-dimethoxyphenyl)ethyl](2-thienylmethyl)amino}-2-oxoethyl)-3,5-dimethoxybenzamide | C29H34N2O6S

N-Cyclopropyl-N-(2-{[2-(3,4-dimethoxyphenyl)ethyl](2-thienylmethyl)amino}-2-oxoethyl)-3,5-dimethoxybenzamide

  • Molecular FormulaC29H34N2O6S
  • Average mass538.655 Da
  • Monoisotopic mass538.213745 Da
  • ChemSpider ID4192451

More details:

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

Benzamide, N-cyclopropyl-N-[2-[[2-(3,4-dimethoxyphenyl)ethyl](2-thienylmethyl)amino]-2-oxoethyl]-3,5-dimethoxy- [ACD/Index Name]
N-Cyclopropyl-N-(2-{[2-(3,4-dimethoxyphenyl)ethyl](2-thienylmethyl)amino}-2-oxoethyl)-3,5-dimethoxybenzamid [German] [ACD/IUPAC Name]
N-Cyclopropyl-N-(2-{[2-(3,4-dimethoxyphenyl)ethyl](2-thienylmethyl)amino}-2-oxoethyl)-3,5-dimethoxybenzamide [ACD/IUPAC Name]
N-Cyclopropyl-N-(2-{[2-(3,4-diméthoxyphényl)éthyl](2-thiénylméthyl)amino}-2-oxoéthyl)-3,5-diméthoxybenzamide [French] [ACD/IUPAC 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: 733.8±60.0 °C at 760 mmHg
Vapour Pressure: 0.0±2.4 mmHg at 25°C
Enthalpy of Vaporization: 107.1±3.0 kJ/mol
Flash Point: 397.6±32.9 °C
Index of Refraction: 1.617
Molar Refractivity: 147.4±0.4 cm3
#H bond acceptors: 8
#H bond donors: 0
#Freely Rotating Bonds: 13
#Rule of 5 Violations: 1
ACD/LogP: 4.50
ACD/LogD (pH 5.5): 4.29
ACD/BCF (pH 5.5): 1070.80
ACD/KOC (pH 5.5): 5131.74
ACD/LogD (pH 7.4): 4.29
ACD/BCF (pH 7.4): 1070.80
ACD/KOC (pH 7.4): 5131.74
Polar Surface Area: 106 Å2
Polarizability: 58.4±0.5 10-24cm3
Surface Tension: 58.0±5.0 dyne/cm
Molar Volume: 421.4±5.0 cm3

Click to predict properties on the Chemicalize site


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