ChemSpider 2D Image | 1-Cyclohexyl-4-({5-[(3,4-difluorophenoxy)methyl]-1,2-oxazol-3-yl}carbonyl)-2-piperazinone | C21H23F2N3O4

1-Cyclohexyl-4-({5-[(3,4-difluorophenoxy)methyl]-1,2-oxazol-3-yl}carbonyl)-2-piperazinone

  • Molecular FormulaC21H23F2N3O4
  • Average mass419.422 Da
  • Monoisotopic mass419.165649 Da
  • ChemSpider ID23054859

More details:

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

1-Cyclohexyl-4-({5-[(3,4-difluorophenoxy)methyl]-1,2-oxazol-3-yl}carbonyl)-2-piperazinone [ACD/IUPAC Name]
1-Cyclohexyl-4-({5-[(3,4-difluorophénoxy)méthyl]-1,2-oxazol-3-yl}carbonyl)-2-pipérazinone [French] [ACD/IUPAC Name]
1-Cyclohexyl-4-({5-[(3,4-difluorphenoxy)methyl]-1,2-oxazol-3-yl}carbonyl)-2-piperazinon [German] [ACD/IUPAC Name]
2-Piperazinone, 1-cyclohexyl-4-[[5-[(3,4-difluorophenoxy)methyl]-3-isoxazolyl]carbonyl]- [ACD/Index Name]
1-cyclohexyl-4-({5-[(3,4-difluorophenoxy)methyl]-3-isoxazolyl}carbonyl)-2-piperazinone

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

Density: 1.3±0.1 g/cm3
Boiling Point: 637.1±55.0 °C at 760 mmHg
Vapour Pressure: 0.0±1.9 mmHg at 25°C
Enthalpy of Vaporization: 94.1±3.0 kJ/mol
Flash Point: 339.1±31.5 °C
Index of Refraction: 1.573
Molar Refractivity: 102.6±0.3 cm3
#H bond acceptors: 7
#H bond donors: 0
#Freely Rotating Bonds: 5
#Rule of 5 Violations: 0
ACD/LogP: 1.00
ACD/LogD (pH 5.5): 1.91
ACD/BCF (pH 5.5): 16.82
ACD/KOC (pH 5.5): 262.44
ACD/LogD (pH 7.4): 1.91
ACD/BCF (pH 7.4): 16.82
ACD/KOC (pH 7.4): 262.44
Polar Surface Area: 76 Å2
Polarizability: 40.7±0.5 10-24cm3
Surface Tension: 54.1±3.0 dyne/cm
Molar Volume: 311.3±3.0 cm3

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