ChemSpider 2D Image | 2-{[4-Amino-5-(2-thienylsulfonyl)-2-pyrimidinyl]sulfanyl}-N-phenylacetamide | C16H14N4O3S3

2-{[4-Amino-5-(2-thienylsulfonyl)-2-pyrimidinyl]sulfanyl}-N-phenylacetamide

  • Molecular FormulaC16H14N4O3S3
  • Average mass406.502 Da
  • Monoisotopic mass406.022797 Da
  • ChemSpider ID22278823

More details:

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

2-{[4-Amino-5-(2-thienylsulfonyl)-2-pyrimidinyl]sulfanyl}-N-phenylacetamid [German] [ACD/IUPAC Name]
2-{[4-Amino-5-(2-thienylsulfonyl)-2-pyrimidinyl]sulfanyl}-N-phenylacetamide [ACD/IUPAC Name]
2-{[4-Amino-5-(2-thiénylsulfonyl)-2-pyrimidinyl]sulfanyl}-N-phénylacétamide [French] [ACD/IUPAC Name]
Acetamide, 2-[[4-amino-5-(2-thienylsulfonyl)-2-pyrimidinyl]thio]-N-phenyl- [ACD/Index Name]
1040655-09-1 [RN]
2-((4-amino-5-(thiophen-2-ylsulfonyl)pyrimidin-2-yl)thio)-N-phenylacetamide
2-{[4-amino-5-(thiophene-2-sulfonyl)pyrimidin-2-yl]sulfanyl}-N-phenylacetamide

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

Density: 1.6±0.1 g/cm3
Boiling Point: 735.3±60.0 °C at 760 mmHg
Vapour Pressure: 0.0±2.4 mmHg at 25°C
Enthalpy of Vaporization: 107.3±3.0 kJ/mol
Flash Point: 398.5±32.9 °C
Index of Refraction: 1.729
Molar Refractivity: 103.4±0.4 cm3
#H bond acceptors: 7
#H bond donors: 3
#Freely Rotating Bonds: 6
#Rule of 5 Violations: 0
ACD/LogP: 3.31
ACD/LogD (pH 5.5): 2.65
ACD/BCF (pH 5.5): 60.65
ACD/KOC (pH 5.5): 657.27
ACD/LogD (pH 7.4): 2.65
ACD/BCF (pH 7.4): 60.65
ACD/KOC (pH 7.4): 657.27
Polar Surface Area: 177 Å2
Polarizability: 41.0±0.5 10-24cm3
Surface Tension: 90.2±5.0 dyne/cm
Molar Volume: 259.3±5.0 cm3

Click to predict properties on the Chemicalize site


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