ChemSpider 2D Image | N-[2-(Diethylamino)(~2~H_4_)ethyl]-2-[(E)-(5-fluoro-2-oxo-1,2-dihydro-3H-indol-3-ylidene)methyl]-3,5-dimethyl-2H-pyrrole-4-carboxamide | C22H23D4FN4O2

N-[2-(Diethylamino)(2H4)ethyl]-2-[(E)-(5-fluoro-2-oxo-1,2-dihydro-3H-indol-3-ylidene)methyl]-3,5-dimethyl-2H-pyrrole-4-carboxamide

  • Molecular FormulaC22H23D4FN4O2
  • Average mass402.498 Da
  • Monoisotopic mass402.236908 Da
  • ChemSpider ID111127878

  • Double-bond stereo - Double-bond stereo

    Non-standard isotope - Non-standard isotope

More details:

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

2H-Pyrrole-4-carboxamide, N-[2-(diethylamino)ethyl-1,1,2,2-d4]-2-[(E)-(5-fluoro-1,2-dihydro-2-oxo-3H-indol-3-ylidene)methyl]-3,5-dimethyl- [ACD/Index Name]
N-[2-(Diethylamino)(2H4)ethyl]-2-[(E)-(5-fluor-2-oxo-1,2-dihydro-3H-indol-3-yliden)methyl]-3,5-dimethyl-2H-pyrrol-4-carboxamid [German] [ACD/IUPAC Name]
N-[2-(Diethylamino)(2H4)ethyl]-2-[(E)-(5-fluoro-2-oxo-1,2-dihydro-3H-indol-3-ylidene)methyl]-3,5-dimethyl-2H-pyrrole-4-carboxamide [ACD/IUPAC Name]
N-[2-(Diéthylamino)(2H4)éthyl]-2-[(E)-(5-fluoro-2-oxo-1,2-dihydro-3H-indol-3-ylidène)méthyl]-3,5-diméthyl-2H-pyrrole-4-carboxamide [French] [ACD/IUPAC Name]

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

Density: 1.2±0.1 g/cm3
Boiling Point: 636.4±55.0 °C at 760 mmHg
Vapour Pressure: 0.0±1.9 mmHg at 25°C
Enthalpy of Vaporization: 94.0±3.0 kJ/mol
Flash Point: 338.7±31.5 °C
Index of Refraction: 1.605
Molar Refractivity: 110.2±0.5 cm3
#H bond acceptors: 6
#H bond donors: 2
#Freely Rotating Bonds: 7
#Rule of 5 Violations: 0
ACD/LogP: 2.36
ACD/LogD (pH 5.5): -0.62
ACD/BCF (pH 5.5): 1.00
ACD/KOC (pH 5.5): 1.00
ACD/LogD (pH 7.4): 0.58
ACD/BCF (pH 7.4): 1.00
ACD/KOC (pH 7.4): 7.09
Polar Surface Area: 74 Å2
Polarizability: 43.7±0.5 10-24cm3
Surface Tension: 42.0±7.0 dyne/cm
Molar Volume: 319.9±7.0 cm3

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