ChemSpider 2D Image | N-(2-{[Cyclohexyl(methyl)amino]methyl}phenyl)-2-[4-(4-fluorophenyl)-2-methyl-1,3-thiazol-5-yl]acetamide | C26H30FN3OS

N-(2-{[Cyclohexyl(methyl)amino]methyl}phenyl)-2-[4-(4-fluorophenyl)-2-methyl-1,3-thiazol-5-yl]acetamide

  • Molecular FormulaC26H30FN3OS
  • Average mass451.599 Da
  • Monoisotopic mass451.209351 Da
  • ChemSpider ID30194934

More details:

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

5-Thiazoleacetamide, N-[2-[(cyclohexylmethylamino)methyl]phenyl]-4-(4-fluorophenyl)-2-methyl- [ACD/Index Name]
N-(2-{[Cyclohexyl(methyl)amino]methyl}phenyl)-2-[4-(4-fluorophenyl)-2-methyl-1,3-thiazol-5-yl]acetamide [ACD/IUPAC Name]
N-(2-{[Cyclohexyl(méthyl)amino]méthyl}phényl)-2-[4-(4-fluorophényl)-2-méthyl-1,3-thiazol-5-yl]acétamide [French] [ACD/IUPAC Name]
N-(2-{[Cyclohexyl(methyl)amino]methyl}phenyl)-2-[4-(4-fluorphenyl)-2-methyl-1,3-thiazol-5-yl]acetamid [German] [ACD/IUPAC 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: 643.3±55.0 °C at 760 mmHg
Vapour Pressure: 0.0±1.9 mmHg at 25°C
Enthalpy of Vaporization: 94.9±3.0 kJ/mol
Flash Point: 342.9±31.5 °C
Index of Refraction: 1.618
Molar Refractivity: 128.7±0.4 cm3
#H bond acceptors: 4
#H bond donors: 1
#Freely Rotating Bonds: 7
#Rule of 5 Violations: 1
ACD/LogP: 5.01
ACD/LogD (pH 5.5): 1.99
ACD/BCF (pH 5.5): 3.84
ACD/KOC (pH 5.5): 13.73
ACD/LogD (pH 7.4): 3.46
ACD/BCF (pH 7.4): 113.88
ACD/KOC (pH 7.4): 406.99
Polar Surface Area: 73 Å2
Polarizability: 51.0±0.5 10-24cm3
Surface Tension: 55.4±5.0 dyne/cm
Molar Volume: 367.5±5.0 cm3

Click to predict properties on the Chemicalize site


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