ChemSpider 2D Image | N-(3-Chloro-4-fluorophenyl)-3-[4-(3-furoyl)-1,4-diazepan-1-yl]propanamide | C19H21ClFN3O3

N-(3-Chloro-4-fluorophenyl)-3-[4-(3-furoyl)-1,4-diazepan-1-yl]propanamide

  • Molecular FormulaC19H21ClFN3O3
  • Average mass393.840 Da
  • Monoisotopic mass393.125549 Da
  • ChemSpider ID35098599

More details:

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

1H-1,4-Diazepine-1-propanamide, N-(3-chloro-4-fluorophenyl)-4-(3-furanylcarbonyl)hexahydro- [ACD/Index Name]
N-(3-Chlor-4-fluorphenyl)-3-[4-(3-furoyl)-1,4-diazepan-1-yl]propanamid [German] [ACD/IUPAC Name]
N-(3-Chloro-4-fluorophenyl)-3-[4-(3-furoyl)-1,4-diazepan-1-yl]propanamide [ACD/IUPAC Name]
N-(3-Chloro-4-fluorophényl)-3-[4-(3-furoyl)-1,4-diazépan-1-yl]propanamide [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: 590.5±50.0 °C at 760 mmHg
Vapour Pressure: 0.0±1.7 mmHg at 25°C
Enthalpy of Vaporization: 88.1±3.0 kJ/mol
Flash Point: 310.9±30.1 °C
Index of Refraction: 1.589
Molar Refractivity: 100.2±0.3 cm3
#H bond acceptors: 6
#H bond donors: 1
#Freely Rotating Bonds: 5
#Rule of 5 Violations: 0
ACD/LogP: 2.92
ACD/LogD (pH 5.5): 1.10
ACD/BCF (pH 5.5): 1.79
ACD/KOC (pH 5.5): 20.10
ACD/LogD (pH 7.4): 2.44
ACD/BCF (pH 7.4): 38.90
ACD/KOC (pH 7.4): 437.22
Polar Surface Area: 66 Å2
Polarizability: 39.7±0.5 10-24cm3
Surface Tension: 52.3±3.0 dyne/cm
Molar Volume: 297.3±3.0 cm3

Click to predict properties on the Chemicalize site


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