ChemSpider 2D Image | N-(3,4-Difluorophenyl)-1-({1-[1-(3,4-dimethoxyphenyl)ethyl]-5-oxo-3-pyrrolidinyl}carbonyl)-4-piperidinecarboxamide | C27H31F2N3O5

N-(3,4-Difluorophenyl)-1-({1-[1-(3,4-dimethoxyphenyl)ethyl]-5-oxo-3-pyrrolidinyl}carbonyl)-4-piperidinecarboxamide

  • Molecular FormulaC27H31F2N3O5
  • Average mass515.549 Da
  • Monoisotopic mass515.223206 Da
  • ChemSpider ID125281700

More details:

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

4-Piperidinecarboxamide, N-(3,4-difluorophenyl)-1-[[1-[1-(3,4-dimethoxyphenyl)ethyl]-5-oxo-3-pyrrolidinyl]carbonyl]- [ACD/Index Name]
N-(3,4-Difluorophenyl)-1-({1-[1-(3,4-dimethoxyphenyl)ethyl]-5-oxo-3-pyrrolidinyl}carbonyl)-4-piperidinecarboxamide [ACD/IUPAC Name]
N-(3,4-Difluorophényl)-1-({1-[1-(3,4-diméthoxyphényl)éthyl]-5-oxo-3-pyrrolidinyl}carbonyl)-4-pipéridinecarboxamide [French] [ACD/IUPAC Name]
N-(3,4-Difluorphenyl)-1-({1-[1-(3,4-dimethoxyphenyl)ethyl]-5-oxo-3-pyrrolidinyl}carbonyl)-4-piperidincarboxamid [German] [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: 739.9±60.0 °C at 760 mmHg
Vapour Pressure: 0.0±2.4 mmHg at 25°C
Enthalpy of Vaporization: 107.9±3.0 kJ/mol
Flash Point: 401.3±32.9 °C
Index of Refraction: 1.590
Molar Refractivity: 132.2±0.3 cm3
#H bond acceptors: 8
#H bond donors: 1
#Freely Rotating Bonds: 7
#Rule of 5 Violations: 1
ACD/LogP: 2.92
ACD/LogD (pH 5.5): 2.71
ACD/BCF (pH 5.5): 67.14
ACD/KOC (pH 5.5): 706.94
ACD/LogD (pH 7.4): 2.71
ACD/BCF (pH 7.4): 67.14
ACD/KOC (pH 7.4): 706.94
Polar Surface Area: 88 Å2
Polarizability: 52.4±0.5 10-24cm3
Surface Tension: 54.0±3.0 dyne/cm
Molar Volume: 391.7±3.0 cm3

Click to predict properties on the Chemicalize site


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