ChemSpider 2D Image | 3-[(2-Cyclopropyl-1,3-thiazol-4-yl)methyl]-1-[3-(ethylsulfanyl)cyclopentyl]-1-methylurea | C16H25N3OS2

3-[(2-Cyclopropyl-1,3-thiazol-4-yl)methyl]-1-[3-(ethylsulfanyl)cyclopentyl]-1-methylurea

  • Molecular FormulaC16H25N3OS2
  • Average mass339.519 Da
  • Monoisotopic mass339.143890 Da
  • ChemSpider ID35153246

More details:

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

3-[(2-Cyclopropyl-1,3-thiazol-4-yl)methyl]-1-[3-(ethylsulfanyl)cyclopentyl]-1-methylharnstoff [German] [ACD/IUPAC Name]
3-[(2-Cyclopropyl-1,3-thiazol-4-yl)methyl]-1-[3-(ethylsulfanyl)cyclopentyl]-1-methylurea [ACD/IUPAC Name]
3-[(2-Cyclopropyl-1,3-thiazol-4-yl)méthyl]-1-[3-(éthylsulfanyl)cyclopentyl]-1-méthylurée [French] [ACD/IUPAC Name]
Urea, N'-[(2-cyclopropyl-4-thiazolyl)methyl]-N-[3-(ethylthio)cyclopentyl]-N-methyl- [ACD/Index 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: 565.3±50.0 °C at 760 mmHg
Vapour Pressure: 0.0±1.5 mmHg at 25°C
Enthalpy of Vaporization: 84.9±3.0 kJ/mol
Flash Point: 295.7±30.1 °C
Index of Refraction: 1.603
Molar Refractivity: 94.4±0.4 cm3
#H bond acceptors: 4
#H bond donors: 1
#Freely Rotating Bonds: 6
#Rule of 5 Violations: 0
ACD/LogP: 2.35
ACD/LogD (pH 5.5): 2.72
ACD/BCF (pH 5.5): 68.95
ACD/KOC (pH 5.5): 720.27
ACD/LogD (pH 7.4): 2.72
ACD/BCF (pH 7.4): 69.04
ACD/KOC (pH 7.4): 721.13
Polar Surface Area: 99 Å2
Polarizability: 37.4±0.5 10-24cm3
Surface Tension: 55.5±5.0 dyne/cm
Molar Volume: 274.9±5.0 cm3

Click to predict properties on the Chemicalize site


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