ChemSpider 2D Image | Diethyl 5-({2-[4-(diethylsulfamoyl)phenyl]-2-oxoethyl}amino)-3-methyl-2,4-thiophenedicarboxylate | C23H30N2O7S2

Diethyl 5-({2-[4-(diethylsulfamoyl)phenyl]-2-oxoethyl}amino)-3-methyl-2,4-thiophenedicarboxylate

  • Molecular FormulaC23H30N2O7S2
  • Average mass510.624 Da
  • Monoisotopic mass510.149445 Da
  • ChemSpider ID32597094

More details:

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

2,4-Thiophenedicarboxylic acid, 5-[[2-[4-[(diethylamino)sulfonyl]phenyl]-2-oxoethyl]amino]-3-methyl-, diethyl ester [ACD/Index Name]
5-({2-[4-(Diéthylsulfamoyl)phényl]-2-oxoéthyl}amino)-3-méthyl-2,4-thiophènedicarboxylate de diéthyle [French] [ACD/IUPAC Name]
Diethyl 5-({2-[4-(diethylsulfamoyl)phenyl]-2-oxoethyl}amino)-3-methyl-2,4-thiophenedicarboxylate [ACD/IUPAC Name]
Diethyl-5-({2-[4-(diethylsulfamoyl)phenyl]-2-oxoethyl}amino)-3-methyl-2,4-thiophendicarboxylat [German] [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: 665.3±65.0 °C at 760 mmHg
Vapour Pressure: 0.0±2.0 mmHg at 25°C
Enthalpy of Vaporization: 97.8±3.0 kJ/mol
Flash Point: 356.1±34.3 °C
Index of Refraction: 1.567
Molar Refractivity: 130.0±0.4 cm3
#H bond acceptors: 9
#H bond donors: 1
#Freely Rotating Bonds: 14
#Rule of 5 Violations: 2
ACD/LogP: 6.78
ACD/LogD (pH 5.5): 5.52
ACD/BCF (pH 5.5): 9226.58
ACD/KOC (pH 5.5): 23975.41
ACD/LogD (pH 7.4): 5.52
ACD/BCF (pH 7.4): 9226.58
ACD/KOC (pH 7.4): 23975.41
Polar Surface Area: 156 Å2
Polarizability: 51.5±0.5 10-24cm3
Surface Tension: 51.6±3.0 dyne/cm
Molar Volume: 397.9±3.0 cm3

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