ChemSpider 2D Image | 2-[(5-Oxo-1-propyl-3-pyrrolidinyl)sulfamoyl]-4,5,6,7-tetrahydrothieno[2,3-c]pyridine-3-carboxylic acid | C15H21N3O5S2

2-[(5-Oxo-1-propyl-3-pyrrolidinyl)sulfamoyl]-4,5,6,7-tetrahydrothieno[2,3-c]pyridine-3-carboxylic acid

  • Molecular FormulaC15H21N3O5S2
  • Average mass387.474 Da
  • Monoisotopic mass387.092255 Da
  • ChemSpider ID29628608

More details:

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

2-[(5-Oxo-1-propyl-3-pyrrolidinyl)sulfamoyl]-4,5,6,7-tetrahydrothieno[2,3-c]pyridin-3-carbonsäure [German] [ACD/IUPAC Name]
2-[(5-Oxo-1-propyl-3-pyrrolidinyl)sulfamoyl]-4,5,6,7-tetrahydrothieno[2,3-c]pyridine-3-carboxylic acid [ACD/IUPAC Name]
Acide 2-[(5-oxo-1-propyl-3-pyrrolidinyl)sulfamoyl]-4,5,6,7-tétrahydrothiéno[2,3-c]pyridine-3-carboxylique [French] [ACD/IUPAC Name]
Thieno[2,3-c]pyridine-3-carboxylic acid, 4,5,6,7-tetrahydro-2-[[(5-oxo-1-propyl-3-pyrrolidinyl)amino]sulfonyl]- [ACD/Index Name]
2-{[(5-oxo-1-propylpyrrolidin-3-yl)amino]sulfonyl}-4,5,6,7-tetrahydrothieno[2,3-c]pyridine-3-carboxylic acid

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

Density: 1.5±0.1 g/cm3
Boiling Point: 672.9±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: 360.7±34.3 °C
Index of Refraction: 1.655
Molar Refractivity: 93.5±0.4 cm3
#H bond acceptors: 8
#H bond donors: 3
#Freely Rotating Bonds: 6
#Rule of 5 Violations: 0
ACD/LogP: -0.35
ACD/LogD (pH 5.5): -1.97
ACD/BCF (pH 5.5): 1.00
ACD/KOC (pH 5.5): 1.00
ACD/LogD (pH 7.4): -1.99
ACD/BCF (pH 7.4): 1.00
ACD/KOC (pH 7.4): 1.00
Polar Surface Area: 152 Å2
Polarizability: 37.1±0.5 10-24cm3
Surface Tension: 76.4±5.0 dyne/cm
Molar Volume: 254.6±5.0 cm3

Click to predict properties on the Chemicalize site


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