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ChemSpider 2D Image | N-[(5-Carbamoyl-1H-pyrrol-3-yl)sulfonyl]glycyl-N-isopropylglycine | C12H18N4O6S

N-[(5-Carbamoyl-1H-pyrrol-3-yl)sulfonyl]glycyl-N-isopropylglycine

  • Molecular FormulaC12H18N4O6S
  • Average mass346.359 Da
  • Monoisotopic mass346.094696 Da
  • ChemSpider ID54621203

More details:

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

Glycine, N-[[5-(aminocarbonyl)-1H-pyrrol-3-yl]sulfonyl]glycyl-N-(1-methylethyl)- [ACD/Index Name]
N-[(5-Carbamoyl-1H-pyrrol-3-yl)sulfonyl]glycyl-N-isopropylglycin [German] [ACD/IUPAC Name]
N-[(5-Carbamoyl-1H-pyrrol-3-yl)sulfonyl]glycyl-N-isopropylglycine [ACD/IUPAC Name]
N-[(5-Carbamoyl-1H-pyrrol-3-yl)sulfonyl]glycyl-N-isopropylglycine [French] [ACD/IUPAC Name]

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

Density: 1.5±0.1 g/cm3
Boiling Point: 672.5±65.0 °C at 760 mmHg
Vapour Pressure: 0.0±2.2 mmHg at 25°C
Enthalpy of Vaporization: 103.8±3.0 kJ/mol
Flash Point: 360.5±34.3 °C
Index of Refraction: 1.591
Molar Refractivity: 79.6±0.4 cm3
#H bond acceptors: 10
#H bond donors: 5
#Freely Rotating Bonds: 8
#Rule of 5 Violations: 2
ACD/LogP: -0.63
ACD/LogD (pH 5.5): -3.28
ACD/BCF (pH 5.5): 1.00
ACD/KOC (pH 5.5): 1.00
ACD/LogD (pH 7.4): -4.47
ACD/BCF (pH 7.4): 1.00
ACD/KOC (pH 7.4): 1.00
Polar Surface Area: 171 Å2
Polarizability: 31.5±0.5 10-24cm3
Surface Tension: 68.8±3.0 dyne/cm
Molar Volume: 235.5±3.0 cm3

Click to predict properties on the Chemicalize site


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