ChemSpider 2D Image | N-[2-(Diethylamino)ethyl]-N-(4-ethoxy-1,3-benzothiazol-2-yl)-4-(1-pyrrolidinylsulfonyl)benzamide | C26H34N4O4S2

N-[2-(Diethylamino)ethyl]-N-(4-ethoxy-1,3-benzothiazol-2-yl)-4-(1-pyrrolidinylsulfonyl)benzamide

  • Molecular FormulaC26H34N4O4S2
  • Average mass530.703 Da
  • Monoisotopic mass530.202148 Da
  • ChemSpider ID22219727

More details:

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

Benzamide, N-[2-(diethylamino)ethyl]-N-(4-ethoxy-2-benzothiazolyl)-4-(1-pyrrolidinylsulfonyl)- [ACD/Index Name]
N-[2-(Diethylamino)ethyl]-N-(4-ethoxy-1,3-benzothiazol-2-yl)-4-(1-pyrrolidinylsulfonyl)benzamid [German] [ACD/IUPAC Name]
N-[2-(Diethylamino)ethyl]-N-(4-ethoxy-1,3-benzothiazol-2-yl)-4-(1-pyrrolidinylsulfonyl)benzamide [ACD/IUPAC Name]
N-[2-(Diéthylamino)éthyl]-N-(4-éthoxy-1,3-benzothiazol-2-yl)-4-(1-pyrrolidinylsulfonyl)benzamide [French] [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: 665.5±65.0 °C at 760 mmHg
Vapour Pressure: 0.0±2.0 mmHg at 25°C
Enthalpy of Vaporization: 97.9±3.0 kJ/mol
Flash Point: 356.3±34.3 °C
Index of Refraction: 1.625
Molar Refractivity: 145.4±0.4 cm3
#H bond acceptors: 8
#H bond donors: 0
#Freely Rotating Bonds: 11
#Rule of 5 Violations: 2
ACD/LogP: 5.24
ACD/LogD (pH 5.5): 1.66
ACD/BCF (pH 5.5): 2.25
ACD/KOC (pH 5.5): 9.84
ACD/LogD (pH 7.4): 3.22
ACD/BCF (pH 7.4): 81.95
ACD/KOC (pH 7.4): 357.90
Polar Surface Area: 120 Å2
Polarizability: 57.7±0.5 10-24cm3
Surface Tension: 57.8±3.0 dyne/cm
Molar Volume: 411.6±3.0 cm3

Click to predict properties on the Chemicalize site


Advertisement