ChemSpider 2D Image | N-[2-(Dimethylamino)-2-(2-thienyl)ethyl]-N~3~-[(4-ethoxyphenyl)sulfonyl]-beta-alaninamide | C19H27N3O4S2

N-[2-(Dimethylamino)-2-(2-thienyl)ethyl]-N3-[(4-ethoxyphenyl)sulfonyl]-β-alaninamide

  • Molecular FormulaC19H27N3O4S2
  • Average mass425.565 Da
  • Monoisotopic mass425.144287 Da
  • ChemSpider ID22436913

More details:

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

N-[2-(Dimethylamino)-2-(2-thienyl)ethyl]-N3-[(4-ethoxyphenyl)sulfonyl]-β-alaninamid [German] [ACD/IUPAC Name]
N-[2-(Dimethylamino)-2-(2-thienyl)ethyl]-N3-[(4-ethoxyphenyl)sulfonyl]-β-alaninamide [ACD/IUPAC Name]
N-[2-(Diméthylamino)-2-(2-thiényl)éthyl]-N3-[(4-éthoxyphényl)sulfonyl]-β-alaninamide [French] [ACD/IUPAC Name]
Propanamide, N-[2-(dimethylamino)-2-(2-thienyl)ethyl]-3-[[(4-ethoxyphenyl)sulfonyl]amino]- [ACD/Index Name]

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

Density: 1.2±0.1 g/cm3
Boiling Point:
Vapour Pressure:
Enthalpy of Vaporization:
Flash Point:
Index of Refraction: 1.572
Molar Refractivity: 113.1±0.4 cm3
#H bond acceptors: 7
#H bond donors: 2
#Freely Rotating Bonds: 11
#Rule of 5 Violations: 0
ACD/LogP: 2.88
ACD/LogD (pH 5.5): 0.62
ACD/BCF (pH 5.5): 1.00
ACD/KOC (pH 5.5): 11.57
ACD/LogD (pH 7.4): 1.92
ACD/BCF (pH 7.4): 15.90
ACD/KOC (pH 7.4): 232.41
Polar Surface Area: 124 Å2
Polarizability: 44.8±0.5 10-24cm3
Surface Tension: 48.5±3.0 dyne/cm
Molar Volume: 343.7±3.0 cm3

Click to predict properties on the Chemicalize site


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