ChemSpider 2D Image | 4-(3,4-Dichlorophenoxy)-3-{[(3-fluorophenyl)carbamoyl]amino}-N-[2-(1-pyrrolidinyl)ethyl]benzamide | C26H25Cl2FN4O3

4-(3,4-Dichlorophenoxy)-3-{[(3-fluorophenyl)carbamoyl]amino}-N-[2-(1-pyrrolidinyl)ethyl]benzamide

  • Molecular FormulaC26H25Cl2FN4O3
  • Average mass531.406 Da
  • Monoisotopic mass530.128784 Da
  • ChemSpider ID9852895

More details:

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

4-(3,4-Dichlorophenoxy)-3-{[(3-fluorophenyl)carbamoyl]amino}-N-[2-(1-pyrrolidinyl)ethyl]benzamide [ACD/IUPAC Name]
4-(3,4-Dichlorophénoxy)-3-{[(3-fluorophényl)carbamoyl]amino}-N-[2-(1-pyrrolidinyl)éthyl]benzamide [French] [ACD/IUPAC Name]
4-(3,4-Dichlorphenoxy)-3-{[(3-fluorphenyl)carbamoyl]amino}-N-[2-(1-pyrrolidinyl)ethyl]benzamid [German] [ACD/IUPAC Name]
Benzamide, 4-(3,4-dichlorophenoxy)-3-[[[(3-fluorophenyl)amino]carbonyl]amino]-N-[2-(1-pyrrolidinyl)ethyl]- [ACD/Index Name]

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

Density: 1.4±0.1 g/cm3
Boiling Point: 575.8±50.0 °C at 760 mmHg
Vapour Pressure: 0.0±1.6 mmHg at 25°C
Enthalpy of Vaporization: 86.2±3.0 kJ/mol
Flash Point: 302.0±30.1 °C
Index of Refraction: 1.653
Molar Refractivity: 139.6±0.3 cm3
#H bond acceptors: 7
#H bond donors: 3
#Freely Rotating Bonds: 8
#Rule of 5 Violations: 2
ACD/LogP: 6.06
ACD/LogD (pH 5.5): 2.76
ACD/BCF (pH 5.5): 13.85
ACD/KOC (pH 5.5): 31.64
ACD/LogD (pH 7.4): 3.90
ACD/BCF (pH 7.4): 193.17
ACD/KOC (pH 7.4): 441.25
Polar Surface Area: 83 Å2
Polarizability: 55.3±0.5 10-24cm3
Surface Tension: 60.3±3.0 dyne/cm
Molar Volume: 381.2±3.0 cm3

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