ChemSpider 2D Image | Nalpha-(3,6-Dichloro-2-methoxybenzoyl)-4-fluoro-N-[2-(6-methoxy-2,3-dihydro-1H-inden-1-yl)ethyl]phenylalaninamide | C29H29Cl2FN2O4

Nα-(3,6-Dichloro-2-methoxybenzoyl)-4-fluoro-N-[2-(6-methoxy-2,3-dihydro-1H-inden-1-yl)ethyl]phenylalaninamide

  • Molecular FormulaC29H29Cl2FN2O4
  • Average mass559.456 Da
  • Monoisotopic mass558.148865 Da
  • ChemSpider ID121170157

More details:

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

Benzenepropanamide, α-[(3,6-dichloro-2-methoxybenzoyl)amino]-N-[2-(2,3-dihydro-6-methoxy-1H-inden-1-yl)ethyl]-4-fluoro- [ACD/Index Name]
Nα-(3,6-Dichlor-2-methoxybenzoyl)-4-fluor-N-[2-(6-methoxy-2,3-dihydro-1H-inden-1-yl)ethyl]phenylalaninamid [German] [ACD/IUPAC Name]
Nα-(3,6-Dichloro-2-methoxybenzoyl)-4-fluoro-N-[2-(6-methoxy-2,3-dihydro-1H-inden-1-yl)ethyl]phenylalaninamide [ACD/IUPAC Name]
Nα-(3,6-Dichloro-2-méthoxybenzoyl)-4-fluoro-N-[2-(6-méthoxy-2,3-dihydro-1H-indén-1-yl)éthyl]phénylalaninamide [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: 711.7±60.0 °C at 760 mmHg
Vapour Pressure: 0.0±2.3 mmHg at 25°C
Enthalpy of Vaporization: 104.1±3.0 kJ/mol
Flash Point: 384.2±32.9 °C
Index of Refraction: 1.589
Molar Refractivity: 146.1±0.3 cm3
#H bond acceptors: 6
#H bond donors: 2
#Freely Rotating Bonds: 10
#Rule of 5 Violations: 2
ACD/LogP: 6.16
ACD/LogD (pH 5.5): 6.02
ACD/BCF (pH 5.5): 22280.29
ACD/KOC (pH 5.5): 45063.73
ACD/LogD (pH 7.4): 6.02
ACD/BCF (pH 7.4): 22279.12
ACD/KOC (pH 7.4): 45061.36
Polar Surface Area: 77 Å2
Polarizability: 57.9±0.5 10-24cm3
Surface Tension: 47.9±3.0 dyne/cm
Molar Volume: 433.5±3.0 cm3

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