ChemSpider 2D Image | N-(3,5-Dichloro-4-hydroxyphenyl)-Nalpha-{3-[(3,4-dimethoxyphenyl)sulfonyl]propanoyl}phenylalaninamide | C26H26Cl2N2O7S

N-(3,5-Dichloro-4-hydroxyphenyl)-Nα-{3-[(3,4-dimethoxyphenyl)sulfonyl]propanoyl}phenylalaninamide

  • Molecular FormulaC26H26Cl2N2O7S
  • Average mass581.465 Da
  • Monoisotopic mass580.083801 Da
  • ChemSpider ID120740413

More details:

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

Benzenepropanamide, N-(3,5-dichloro-4-hydroxyphenyl)-α-[[3-[(3,4-dimethoxyphenyl)sulfonyl]-1-oxopropyl]amino]- [ACD/Index Name]
N-(3,5-Dichlor-4-hydroxyphenyl)-Nα-{3-[(3,4-dimethoxyphenyl)sulfonyl]propanoyl}phenylalaninamid [German] [ACD/IUPAC Name]
N-(3,5-Dichloro-4-hydroxyphenyl)-Nα-{3-[(3,4-dimethoxyphenyl)sulfonyl]propanoyl}phenylalaninamide [ACD/IUPAC Name]
N-(3,5-Dichloro-4-hydroxyphényl)-Nα-{3-[(3,4-diméthoxyphényl)sulfonyl]propanoyl}phénylalaninamide [French] [ACD/IUPAC Name]

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

Density: 1.4±0.1 g/cm3
Boiling Point: 848.0±65.0 °C at 760 mmHg
Vapour Pressure: 0.0±3.3 mmHg at 25°C
Enthalpy of Vaporization: 127.4±3.0 kJ/mol
Flash Point: 466.6±34.3 °C
Index of Refraction: 1.617
Molar Refractivity: 144.2±0.4 cm3
#H bond acceptors: 9
#H bond donors: 3
#Freely Rotating Bonds: 11
#Rule of 5 Violations: 1
ACD/LogP: 3.95
ACD/LogD (pH 5.5): 3.79
ACD/BCF (pH 5.5): 440.15
ACD/KOC (pH 5.5): 2689.97
ACD/LogD (pH 7.4): 3.23
ACD/BCF (pH 7.4): 122.74
ACD/KOC (pH 7.4): 750.13
Polar Surface Area: 139 Å2
Polarizability: 57.2±0.5 10-24cm3
Surface Tension: 59.2±3.0 dyne/cm
Molar Volume: 412.1±3.0 cm3

Click to predict properties on the Chemicalize site


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