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Search term: ZHAYZHPVOTVNGJ (Found by InChIKey (skeleton match))
ChemSpider 2D Image | N-{2-[(4-Chlorophenyl)(methyl)amino]ethyl}-Nalpha-[4-(hexyloxy)benzoyl]tyrosinamide | C31H38ClN3O4

N-{2-[(4-Chlorophenyl)(methyl)amino]ethyl}-Nα-[4-(hexyloxy)benzoyl]tyrosinamide

  • Molecular FormulaC31H38ClN3O4
  • Average mass552.104 Da
  • Monoisotopic mass551.255066 Da
  • ChemSpider ID121067977

More details:

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

Benzenepropanamide, N-[2-[(4-chlorophenyl)methylamino]ethyl]-α-[[4-(hexyloxy)benzoyl]amino]-4-hydroxy- [ACD/Index Name]
N-{2-[(4-Chlorophenyl)(methyl)amino]ethyl}-Nα-[4-(hexyloxy)benzoyl]tyrosinamide [ACD/IUPAC Name]
N-{2-[(4-Chlorophényl)(méthyl)amino]éthyl}-Nα-[4-(hexyloxy)benzoyl]tyrosinamide [French] [ACD/IUPAC Name]
N-{2-[(4-Chlorphenyl)(methyl)amino]ethyl}-Nα-[4-(hexyloxy)benzoyl]tyrosinamid [German] [ACD/IUPAC Name]

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

Density: 1.2±0.1 g/cm3
Boiling Point: 799.8±60.0 °C at 760 mmHg
Vapour Pressure: 0.0±2.9 mmHg at 25°C
Enthalpy of Vaporization: 120.3±3.0 kJ/mol
Flash Point: 437.5±32.9 °C
Index of Refraction: 1.595
Molar Refractivity: 157.0±0.3 cm3
#H bond acceptors: 7
#H bond donors: 3
#Freely Rotating Bonds: 15
#Rule of 5 Violations: 2
ACD/LogP: 6.68
ACD/LogD (pH 5.5): 6.05
ACD/BCF (pH 5.5): 23232.94
ACD/KOC (pH 5.5): 45779.02
ACD/LogD (pH 7.4): 6.07
ACD/BCF (pH 7.4): 24316.87
ACD/KOC (pH 7.4): 47914.84
Polar Surface Area: 91 Å2
Polarizability: 62.2±0.5 10-24cm3
Surface Tension: 49.5±3.0 dyne/cm
Molar Volume: 462.1±3.0 cm3

Click to predict properties on the Chemicalize site


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