ChemSpider 2D Image | N-Cyclopropyl-4-{(E)-[4-(2-fluorobenzyl)-3-oxo-3,4-dihydro-2H-1,4-benzoxazin-2-ylidene]methyl}benzamide | C26H21FN2O3

N-Cyclopropyl-4-{(E)-[4-(2-fluorobenzyl)-3-oxo-3,4-dihydro-2H-1,4-benzoxazin-2-ylidene]methyl}benzamide

  • Molecular FormulaC26H21FN2O3
  • Average mass428.455 Da
  • Monoisotopic mass428.153625 Da
  • ChemSpider ID23018283

  • Double-bond stereo - Double-bond stereo

More details:

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

Benzamide, N-cyclopropyl-4-[(E)-[4-[(2-fluorophenyl)methyl]-3,4-dihydro-3-oxo-2H-1,4-benzoxazin-2-ylidene]methyl]- [ACD/Index Name]
N-Cyclopropyl-4-{(E)-[4-(2-fluorbenzyl)-3-oxo-3,4-dihydro-2H-1,4-benzoxazin-2-yliden]methyl}benzamid [German] [ACD/IUPAC Name]
N-Cyclopropyl-4-{(E)-[4-(2-fluorobenzyl)-3-oxo-3,4-dihydro-2H-1,4-benzoxazin-2-ylidene]methyl}benzamide [ACD/IUPAC Name]
N-Cyclopropyl-4-{(E)-[4-(2-fluorobenzyl)-3-oxo-3,4-dihydro-2H-1,4-benzoxazin-2-ylidène]méthyl}benzamide [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: 634.2±55.0 °C at 760 mmHg
Vapour Pressure: 0.0±1.9 mmHg at 25°C
Enthalpy of Vaporization: 93.7±3.0 kJ/mol
Flash Point: 337.3±31.5 °C
Index of Refraction: 1.679
Molar Refractivity: 118.4±0.4 cm3
#H bond acceptors: 5
#H bond donors: 1
#Freely Rotating Bonds: 5
#Rule of 5 Violations: 0
ACD/LogP: 3.75
ACD/LogD (pH 5.5): 3.75
ACD/BCF (pH 5.5): 418.65
ACD/KOC (pH 5.5): 2620.12
ACD/LogD (pH 7.4): 3.75
ACD/BCF (pH 7.4): 418.65
ACD/KOC (pH 7.4): 2620.13
Polar Surface Area: 59 Å2
Polarizability: 46.9±0.5 10-24cm3
Surface Tension: 63.1±5.0 dyne/cm
Molar Volume: 313.6±5.0 cm3

Click to predict properties on the Chemicalize site


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