ChemSpider 2D Image | N-{2-[(2-Bromophenyl)amino]-2-oxoethyl}-2-[4-(methylsulfanyl)-3-nitrobenzoyl]benzamide | C23H18BrN3O5S

N-{2-[(2-Bromophenyl)amino]-2-oxoethyl}-2-[4-(methylsulfanyl)-3-nitrobenzoyl]benzamide

  • Molecular FormulaC23H18BrN3O5S
  • Average mass528.375 Da
  • Monoisotopic mass527.015076 Da
  • ChemSpider ID22479838

More details:

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

Benzamide, N-[2-[(2-bromophenyl)amino]-2-oxoethyl]-2-[4-(methylthio)-3-nitrobenzoyl]- [ACD/Index Name]
N-{2-[(2-Bromophenyl)amino]-2-oxoethyl}-2-[4-(methylsulfanyl)-3-nitrobenzoyl]benzamide [ACD/IUPAC Name]
N-{2-[(2-Bromophényl)amino]-2-oxoéthyl}-2-[4-(méthylsulfanyl)-3-nitrobenzoyl]benzamide [French] [ACD/IUPAC Name]
N-{2-[(2-Bromphenyl)amino]-2-oxoethyl}-2-[4-(methylsulfanyl)-3-nitrobenzoyl]benzamid [German] [ACD/IUPAC Name]

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

Density: 1.6±0.1 g/cm3
Boiling Point: 781.4±60.0 °C at 760 mmHg
Vapour Pressure: 0.0±2.7 mmHg at 25°C
Enthalpy of Vaporization: 113.7±3.0 kJ/mol
Flash Point: 426.4±32.9 °C
Index of Refraction: 1.698
Molar Refractivity: 128.7±0.4 cm3
#H bond acceptors: 8
#H bond donors: 2
#Freely Rotating Bonds: 8
#Rule of 5 Violations: 1
ACD/LogP: 4.29
ACD/LogD (pH 5.5): 4.14
ACD/BCF (pH 5.5): 818.25
ACD/KOC (pH 5.5): 4232.95
ACD/LogD (pH 7.4): 4.14
ACD/BCF (pH 7.4): 818.22
ACD/KOC (pH 7.4): 4232.84
Polar Surface Area: 146 Å2
Polarizability: 51.0±0.5 10-24cm3
Surface Tension: 74.3±5.0 dyne/cm
Molar Volume: 334.0±5.0 cm3

Click to predict properties on the Chemicalize site


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