ChemSpider 2D Image | N-(2,5-Difluorophenyl)-2-[11-(2-furyl)-1-oxo-1,2,3,4,5,11-hexahydro-10H-dibenzo[b,e][1,4]diazepin-10-yl]acetamide | C25H21F2N3O3

N-(2,5-Difluorophenyl)-2-[11-(2-furyl)-1-oxo-1,2,3,4,5,11-hexahydro-10H-dibenzo[b,e][1,4]diazepin-10-yl]acetamide

  • Molecular FormulaC25H21F2N3O3
  • Average mass449.449 Da
  • Monoisotopic mass449.155090 Da
  • ChemSpider ID23007415

More details:

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

10H-Dibenzo[b,e][1,4]diazepine-10-acetamide, N-(2,5-difluorophenyl)-11-(2-furanyl)-1,2,3,4,5,11-hexahydro-1-oxo- [ACD/Index Name]
N-(2,5-Difluorophenyl)-2-[11-(2-furyl)-1-oxo-1,2,3,4,5,11-hexahydro-10H-dibenzo[b,e][1,4]diazepin-10-yl]acetamide [ACD/IUPAC Name]
N-(2,5-Difluorophényl)-2-[11-(2-furyl)-1-oxo-1,2,3,4,5,11-hexahydro-10H-dibenzo[b,e][1,4]diazépin-10-yl]acétamide [French] [ACD/IUPAC Name]
N-(2,5-Difluorphenyl)-2-[11-(2-furyl)-1-oxo-1,2,3,4,5,11-hexahydro-10H-dibenzo[b,e][1,4]diazepin-10-yl]acetamid [German] [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: 656.2±55.0 °C at 760 mmHg
Vapour Pressure: 0.0±2.0 mmHg at 25°C
Enthalpy of Vaporization: 96.6±3.0 kJ/mol
Flash Point: 350.7±31.5 °C
Index of Refraction: 1.658
Molar Refractivity: 117.3±0.4 cm3
#H bond acceptors: 6
#H bond donors: 2
#Freely Rotating Bonds: 4
#Rule of 5 Violations: 0
ACD/LogP: 3.33
ACD/LogD (pH 5.5): 3.66
ACD/BCF (pH 5.5): 354.02
ACD/KOC (pH 5.5): 2322.33
ACD/LogD (pH 7.4): 3.66
ACD/BCF (pH 7.4): 354.74
ACD/KOC (pH 7.4): 2327.07
Polar Surface Area: 75 Å2
Polarizability: 46.5±0.5 10-24cm3
Surface Tension: 61.7±5.0 dyne/cm
Molar Volume: 318.4±5.0 cm3

Click to predict properties on the Chemicalize site


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