ChemSpider 2D Image | N-(4,6-Difluoro-1,3-benzothiazol-2-yl)-N-[2-(4-morpholinyl)ethyl]-1,3-benzothiazole-6-carboxamide | C21H18F2N4O2S2

N-(4,6-Difluoro-1,3-benzothiazol-2-yl)-N-[2-(4-morpholinyl)ethyl]-1,3-benzothiazole-6-carboxamide

  • Molecular FormulaC21H18F2N4O2S2
  • Average mass460.520 Da
  • Monoisotopic mass460.083923 Da
  • ChemSpider ID21535152

More details:

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

6-Benzothiazolecarboxamide, N-(4,6-difluoro-2-benzothiazolyl)-N-[2-(4-morpholinyl)ethyl]- [ACD/Index Name]
N-(4,6-Difluor-1,3-benzothiazol-2-yl)-N-[2-(4-morpholinyl)ethyl]-1,3-benzothiazol-6-carboxamid [German] [ACD/IUPAC Name]
N-(4,6-Difluoro-1,3-benzothiazol-2-yl)-N-[2-(4-morpholinyl)ethyl]-1,3-benzothiazole-6-carboxamide [ACD/IUPAC Name]
N-(4,6-Difluoro-1,3-benzothiazol-2-yl)-N-[2-(4-morpholinyl)éthyl]-1,3-benzothiazole-6-carboxamide [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: 609.6±65.0 °C at 760 mmHg
Vapour Pressure: 0.0±1.7 mmHg at 25°C
Enthalpy of Vaporization: 90.6±3.0 kJ/mol
Flash Point: 322.5±34.3 °C
Index of Refraction: 1.705
Molar Refractivity: 120.4±0.3 cm3
#H bond acceptors: 6
#H bond donors: 0
#Freely Rotating Bonds: 5
#Rule of 5 Violations: 0
ACD/LogP: 3.25
ACD/LogD (pH 5.5): 2.54
ACD/BCF (pH 5.5): 36.94
ACD/KOC (pH 5.5): 322.96
ACD/LogD (pH 7.4): 3.07
ACD/BCF (pH 7.4): 125.23
ACD/KOC (pH 7.4): 1094.77
Polar Surface Area: 115 Å2
Polarizability: 47.7±0.5 10-24cm3
Surface Tension: 68.6±3.0 dyne/cm
Molar Volume: 310.0±3.0 cm3

Click to predict properties on the Chemicalize site


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