ChemSpider 2D Image | 4-{[(5-Butyl-2-pyrimidinyl)sulfanyl]acetyl}benzenesulfonamide | C16H19N3O3S2

4-{[(5-Butyl-2-pyrimidinyl)sulfanyl]acetyl}benzenesulfonamide

  • Molecular FormulaC16H19N3O3S2
  • Average mass365.470 Da
  • Monoisotopic mass365.086792 Da
  • ChemSpider ID28530162

More details:

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

4-{[(5-Butyl-2-pyrimidinyl)sulfanyl]acetyl}benzenesulfonamide [ACD/IUPAC Name]
4-{[(5-Butyl-2-pyrimidinyl)sulfanyl]acetyl}benzolsulfonamid [German] [ACD/IUPAC Name]
4-{[(5-Butylpyrimidin-2-Yl)sulfanyl]acetyl}benzenesulfonamide
4-{2-[(5-Butyl-2-pyrimidinyl)sulfanyl]acétyl}benzènesulfonamide [French] [ACD/IUPAC Name]
Benzenesulfonamide, 4-[2-[(5-butyl-2-pyrimidinyl)thio]acetyl]- [ACD/Index Name]
E2I

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

Density: 1.4±0.1 g/cm3
Boiling Point: 588.4±60.0 °C at 760 mmHg
Vapour Pressure: 0.0±1.6 mmHg at 25°C
Enthalpy of Vaporization: 87.8±3.0 kJ/mol
Flash Point: 309.7±32.9 °C
Index of Refraction: 1.633
Molar Refractivity: 95.4±0.4 cm3
#H bond acceptors: 6
#H bond donors: 2
#Freely Rotating Bonds: 8
#Rule of 5 Violations: 0
ACD/LogP: 3.08
ACD/LogD (pH 5.5): 2.23
ACD/BCF (pH 5.5): 29.03
ACD/KOC (pH 5.5): 387.92
ACD/LogD (pH 7.4): 2.22
ACD/BCF (pH 7.4): 28.88
ACD/KOC (pH 7.4): 385.81
Polar Surface Area: 137 Å2
Polarizability: 37.8±0.5 10-24cm3
Surface Tension: 69.7±5.0 dyne/cm
Molar Volume: 267.3±5.0 cm3

Click to predict properties on the Chemicalize site


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