Found 1039 results

Search term: MF = 'C_{23}H_{24}F_{3}N_{3}O_{3}'
ChemSpider 2D Image | 4-Oxo-4-[(1S,9R)-6-oxo-7,11-diazatricyclo[7.3.1.0~2,7~]trideca-2,4-dien-11-yl]-N-[3-(trifluoromethyl)benzyl]butanamide | C23H24F3N3O3

4-Oxo-4-[(1S,9R)-6-oxo-7,11-diazatricyclo[7.3.1.02,7]trideca-2,4-dien-11-yl]-N-[3-(trifluoromethyl)benzyl]butanamide

  • Molecular FormulaC23H24F3N3O3
  • Average mass447.450 Da
  • Monoisotopic mass447.176971 Da
  • ChemSpider ID22870730

  • defined stereocentres - 2 of 2 defined stereocentres

More details:

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

1,5-Methano-2H-pyrido[1,2-a][1,5]diazocine-3(4H)-butanamide, 1,5,6,8-tetrahydro-γ,8-dioxo-N-[[3-(trifluoromethyl)phenyl]methyl]-, (1S,5R)- [ACD/Index Name]
4-Oxo-4-[(1S,9R)-6-oxo-7,11-diazatricyclo[7.3.1.02,7]trideca-2,4-dien-11-yl]-N-[3-(trifluormethyl)benzyl]butanamid [German] [ACD/IUPAC Name]
4-Oxo-4-[(1S,9R)-6-oxo-7,11-diazatricyclo[7.3.1.02,7]trideca-2,4-dien-11-yl]-N-[3-(trifluoromethyl)benzyl]butanamide [ACD/IUPAC Name]
4-Oxo-4-[(1S,9R)-6-oxo-7,11-diazatricyclo[7.3.1.02,7]tridéca-2,4-dién-11-yl]-N-[3-(trifluorométhyl)benzyl]butanamide [French] [ACD/IUPAC Name]
1212379-45-7 [RN]

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

Density: 1.4±0.1 g/cm3
Boiling Point: 715.9±60.0 °C at 760 mmHg
Vapour Pressure: 0.0±2.3 mmHg at 25°C
Enthalpy of Vaporization: 104.6±3.0 kJ/mol
Flash Point: 386.8±32.9 °C
Index of Refraction: 1.599
Molar Refractivity: 111.0±0.4 cm3
#H bond acceptors: 6
#H bond donors: 1
#Freely Rotating Bonds: 6
#Rule of 5 Violations: 0
ACD/LogP: 1.27
ACD/LogD (pH 5.5): 1.50
ACD/BCF (pH 5.5): 8.18
ACD/KOC (pH 5.5): 156.60
ACD/LogD (pH 7.4): 1.50
ACD/BCF (pH 7.4): 8.18
ACD/KOC (pH 7.4): 156.60
Polar Surface Area: 70 Å2
Polarizability: 44.0±0.5 10-24cm3
Surface Tension: 54.3±5.0 dyne/cm
Molar Volume: 324.9±5.0 cm3

Click to predict properties on the Chemicalize site


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