ChemSpider 2D Image | N-(1,3-Benzothiazol-2-yl)-3-[(3,5-dimethyl-1-piperidinyl)sulfonyl]-N-(4-fluorophenyl)benzamide | C27H26FN3O3S2

N-(1,3-Benzothiazol-2-yl)-3-[(3,5-dimethyl-1-piperidinyl)sulfonyl]-N-(4-fluorophenyl)benzamide

  • Molecular FormulaC27H26FN3O3S2
  • Average mass523.642 Da
  • Monoisotopic mass523.139954 Da
  • ChemSpider ID4238665

More details:

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

Benzamide, N-2-benzothiazolyl-3-[(3,5-dimethyl-1-piperidinyl)sulfonyl]-N-(4-fluorophenyl)- [ACD/Index Name]
N-(1,3-Benzothiazol-2-yl)-3-[(3,5-dimethyl-1-piperidinyl)sulfonyl]-N-(4-fluorophenyl)benzamide [ACD/IUPAC Name]
N-(1,3-Benzothiazol-2-yl)-3-[(3,5-diméthyl-1-pipéridinyl)sulfonyl]-N-(4-fluorophényl)benzamide [French] [ACD/IUPAC Name]
N-(1,3-Benzothiazol-2-yl)-3-[(3,5-dimethyl-1-piperidinyl)sulfonyl]-N-(4-fluorphenyl)benzamid [German] [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: 679.0±65.0 °C at 760 mmHg
Vapour Pressure: 0.0±2.1 mmHg at 25°C
Enthalpy of Vaporization: 99.6±3.0 kJ/mol
Flash Point: 364.4±34.3 °C
Index of Refraction: 1.646
Molar Refractivity: 141.4±0.4 cm3
#H bond acceptors: 6
#H bond donors: 0
#Freely Rotating Bonds: 5
#Rule of 5 Violations: 2
ACD/LogP: 7.12
ACD/LogD (pH 5.5): 5.92
ACD/BCF (pH 5.5): 18540.21
ACD/KOC (pH 5.5): 39509.34
ACD/LogD (pH 7.4): 5.92
ACD/BCF (pH 7.4): 18540.70
ACD/KOC (pH 7.4): 39510.38
Polar Surface Area: 107 Å2
Polarizability: 56.1±0.5 10-24cm3
Surface Tension: 56.1±3.0 dyne/cm
Molar Volume: 389.8±3.0 cm3

Click to predict properties on the Chemicalize site


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