ChemSpider 2D Image | N-[(2Z)-4,7-Dichloro-3-ethyl-1,3-benzothiazol-2(3H)-ylidene]-4-(4-morpholinylsulfonyl)benzamide | C20H19Cl2N3O4S2

N-[(2Z)-4,7-Dichloro-3-ethyl-1,3-benzothiazol-2(3H)-ylidene]-4-(4-morpholinylsulfonyl)benzamide

  • Molecular FormulaC20H19Cl2N3O4S2
  • Average mass500.419 Da
  • Monoisotopic mass499.019409 Da
  • ChemSpider ID3835190

  • Double-bond stereo - Double-bond stereo

More details:

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

Benzamide, N-[(2Z)-4,7-dichloro-3-ethyl-2(3H)-benzothiazolylidene]-4-(4-morpholinylsulfonyl)- [ACD/Index Name]
N-[(2Z)-4,7-Dichlor-3-ethyl-1,3-benzothiazol-2(3H)-yliden]-4-(4-morpholinylsulfonyl)benzamid [German] [ACD/IUPAC Name]
N-[(2Z)-4,7-Dichloro-3-ethyl-1,3-benzothiazol-2(3H)-ylidene]-4-(4-morpholinylsulfonyl)benzamide [ACD/IUPAC Name]
N-[(2Z)-4,7-Dichloro-3-éthyl-1,3-benzothiazol-2(3H)-ylidène]-4-(4-morpholinylsulfonyl)benzamide [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: 662.6±65.0 °C at 760 mmHg
Vapour Pressure: 0.0±2.0 mmHg at 25°C
Enthalpy of Vaporization: 97.5±3.0 kJ/mol
Flash Point: 354.5±34.3 °C
Index of Refraction: 1.697
Molar Refractivity: 124.3±0.5 cm3
#H bond acceptors: 7
#H bond donors: 0
#Freely Rotating Bonds: 5
#Rule of 5 Violations: 1
ACD/LogP: 4.44
ACD/LogD (pH 5.5): 4.38
ACD/BCF (pH 5.5): 1250.63
ACD/KOC (pH 5.5): 5734.86
ACD/LogD (pH 7.4): 4.38
ACD/BCF (pH 7.4): 1250.63
ACD/KOC (pH 7.4): 5734.86
Polar Surface Area: 113 Å2
Polarizability: 49.3±0.5 10-24cm3
Surface Tension: 60.7±7.0 dyne/cm
Molar Volume: 322.9±7.0 cm3

Click to predict properties on the Chemicalize site


Advertisement