ChemSpider 2D Image | N-[2-(3,4-Dimethoxyphenyl)ethyl]-3-[4-(2-fluorobenzoyl)-1-piperazinyl]-4-methoxy-N-methylbenzenesulfonamide | C29H34FN3O6S

N-[2-(3,4-Dimethoxyphenyl)ethyl]-3-[4-(2-fluorobenzoyl)-1-piperazinyl]-4-methoxy-N-methylbenzenesulfonamide

  • Molecular FormulaC29H34FN3O6S
  • Average mass571.660 Da
  • Monoisotopic mass571.215210 Da
  • ChemSpider ID22733507

More details:

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

Benzenesulfonamide, N-[2-(3,4-dimethoxyphenyl)ethyl]-3-[4-(2-fluorobenzoyl)-1-piperazinyl]-4-methoxy-N-methyl- [ACD/Index Name]
N-[2-(3,4-Dimethoxyphenyl)ethyl]-3-[4-(2-fluorbenzoyl)-1-piperazinyl]-4-methoxy-N-methylbenzolsulfonamid [German] [ACD/IUPAC Name]
N-[2-(3,4-Dimethoxyphenyl)ethyl]-3-[4-(2-fluorobenzoyl)-1-piperazinyl]-4-methoxy-N-methylbenzenesulfonamide [ACD/IUPAC Name]
N-[2-(3,4-Diméthoxyphényl)éthyl]-3-[4-(2-fluorobenzoyl)-1-pipérazinyl]-4-méthoxy-N-méthylbenzènesulfonamide [French] [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: 742.1±70.0 °C at 760 mmHg
Vapour Pressure: 0.0±2.5 mmHg at 25°C
Enthalpy of Vaporization: 108.2±3.0 kJ/mol
Flash Point: 402.6±35.7 °C
Index of Refraction: 1.588
Molar Refractivity: 151.0±0.4 cm3
#H bond acceptors: 9
#H bond donors: 0
#Freely Rotating Bonds: 10
#Rule of 5 Violations: 1
ACD/LogP: 3.02
ACD/LogD (pH 5.5): 3.52
ACD/BCF (pH 5.5): 279.89
ACD/KOC (pH 5.5): 1964.08
ACD/LogD (pH 7.4): 3.52
ACD/BCF (pH 7.4): 279.90
ACD/KOC (pH 7.4): 1964.11
Polar Surface Area: 97 Å2
Polarizability: 59.8±0.5 10-24cm3
Surface Tension: 49.1±3.0 dyne/cm
Molar Volume: 448.7±3.0 cm3

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