ChemSpider 2D Image | N-{2-[3-(Cyclopentyloxy)phenyl]-2-hydroxyethyl}-Nalpha-(3,4-dichlorobenzoyl)-4-fluorophenylalaninamide | C29H29Cl2FN2O4

N-{2-[3-(Cyclopentyloxy)phenyl]-2-hydroxyethyl}-Nα-(3,4-dichlorobenzoyl)-4-fluorophenylalaninamide

  • Molecular FormulaC29H29Cl2FN2O4
  • Average mass559.456 Da
  • Monoisotopic mass558.148865 Da
  • ChemSpider ID120940234

More details:

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

Benzenepropanamide, N-[2-[3-(cyclopentyloxy)phenyl]-2-hydroxyethyl]-α-[(3,4-dichlorobenzoyl)amino]-4-fluoro- [ACD/Index Name]
N-{2-[3-(Cyclopentyloxy)phenyl]-2-hydroxyethyl}-Nα-(3,4-dichlorbenzoyl)-4-fluorphenylalaninamid [German] [ACD/IUPAC Name]
N-{2-[3-(Cyclopentyloxy)phenyl]-2-hydroxyethyl}-Nα-(3,4-dichlorobenzoyl)-4-fluorophenylalaninamide [ACD/IUPAC Name]
N-{2-[3-(Cyclopentyloxy)phényl]-2-hydroxyéthyl}-Nα-(3,4-dichlorobenzoyl)-4-fluorophénylalaninamide [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: 779.4±60.0 °C at 760 mmHg
Vapour Pressure: 0.0±2.8 mmHg at 25°C
Enthalpy of Vaporization: 119.0±3.0 kJ/mol
Flash Point: 425.2±32.9 °C
Index of Refraction: 1.611
Molar Refractivity: 145.4±0.3 cm3
#H bond acceptors: 6
#H bond donors: 3
#Freely Rotating Bonds: 10
#Rule of 5 Violations: 2
ACD/LogP: 6.27
ACD/LogD (pH 5.5): 5.60
ACD/BCF (pH 5.5): 10556.28
ACD/KOC (pH 5.5): 26400.86
ACD/LogD (pH 7.4): 5.60
ACD/BCF (pH 7.4): 10555.57
ACD/KOC (pH 7.4): 26399.09
Polar Surface Area: 88 Å2
Polarizability: 57.6±0.5 10-24cm3
Surface Tension: 53.6±3.0 dyne/cm
Molar Volume: 418.7±3.0 cm3

Click to predict properties on the Chemicalize site


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