Found 87 results

Search term: MF = 'C_{27}H_{33}F_{2}N_{3}O_{4}'
ChemSpider 2D Image | 3-{[3-(Diethylamino)propyl]amino}-4-(2,4-difluorophenyl)-1-[1-(3,4-dimethoxyphenyl)ethyl]-1H-pyrrole-2,5-dione | C27H33F2N3O4

3-{[3-(Diethylamino)propyl]amino}-4-(2,4-difluorophenyl)-1-[1-(3,4-dimethoxyphenyl)ethyl]-1H-pyrrole-2,5-dione

  • Molecular FormulaC27H33F2N3O4
  • Average mass501.565 Da
  • Monoisotopic mass501.243927 Da
  • ChemSpider ID119298043

More details:

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

1H-Pyrrole-2,5-dione, 3-[[3-(diethylamino)propyl]amino]-4-(2,4-difluorophenyl)-1-[1-(3,4-dimethoxyphenyl)ethyl]- [ACD/Index Name]
3-{[3-(Diethylamino)propyl]amino}-4-(2,4-difluorophenyl)-1-[1-(3,4-dimethoxyphenyl)ethyl]-1H-pyrrole-2,5-dione [ACD/IUPAC Name]
3-{[3-(Diéthylamino)propyl]amino}-4-(2,4-difluorophényl)-1-[1-(3,4-diméthoxyphényl)éthyl]-1H-pyrrole-2,5-dione [French] [ACD/IUPAC Name]
3-{[3-(Diethylamino)propyl]amino}-4-(2,4-difluorphenyl)-1-[1-(3,4-dimethoxyphenyl)ethyl]-1H-pyrrol-2,5-dion [German] [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: 598.0±50.0 °C at 760 mmHg
Vapour Pressure: 0.0±1.7 mmHg at 25°C
Enthalpy of Vaporization: 89.1±3.0 kJ/mol
Flash Point: 315.5±30.1 °C
Index of Refraction: 1.577
Molar Refractivity: 133.7±0.4 cm3
#H bond acceptors: 7
#H bond donors: 1
#Freely Rotating Bonds: 12
#Rule of 5 Violations: 1
ACD/LogP: 4.67
ACD/LogD (pH 5.5): 0.75
ACD/BCF (pH 5.5): 1.00
ACD/KOC (pH 5.5): 2.36
ACD/LogD (pH 7.4): 1.11
ACD/BCF (pH 7.4): 1.00
ACD/KOC (pH 7.4): 5.39
Polar Surface Area: 71 Å2
Polarizability: 53.0±0.5 10-24cm3
Surface Tension: 49.7±5.0 dyne/cm
Molar Volume: 403.1±5.0 cm3

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