ChemSpider 2D Image | {3-Fluoro-1-[(4-methyl-1,3-thiazol-5-yl)methyl]-3-piperidinyl}(1-pyrrolidinyl)methanone | C15H22FN3OS

{3-Fluoro-1-[(4-methyl-1,3-thiazol-5-yl)methyl]-3-piperidinyl}(1-pyrrolidinyl)methanone

  • Molecular FormulaC15H22FN3OS
  • Average mass311.418 Da
  • Monoisotopic mass311.146759 Da
  • ChemSpider ID67962031

More details:

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

{3-Fluor-1-[(4-methyl-1,3-thiazol-5-yl)methyl]-3-piperidinyl}(1-pyrrolidinyl)methanon [German] [ACD/IUPAC Name]
{3-Fluoro-1-[(4-methyl-1,3-thiazol-5-yl)methyl]-3-piperidinyl}(1-pyrrolidinyl)methanone [ACD/IUPAC Name]
{3-Fluoro-1-[(4-méthyl-1,3-thiazol-5-yl)méthyl]-3-pipéridinyl}(1-pyrrolidinyl)méthanone [French] [ACD/IUPAC Name]
Methanone, [3-fluoro-1-[(4-methyl-5-thiazolyl)methyl]-3-piperidinyl]-1-pyrrolidinyl- [ACD/Index Name]
{3-fluoro-1-[(4-methyl-1,3-thiazol-5-yl)methyl]-3-piperidyl}(1-pyrrolidinyl)methanone

Predicted data is generated using the ACD/Labs Percepta Platform - PhysChem Module, version: 14.00

Density: 1.3±0.1 g/cm3
Boiling Point: 449.8±45.0 °C at 760 mmHg
Vapour Pressure: 0.0±1.1 mmHg at 25°C
Enthalpy of Vaporization: 70.9±3.0 kJ/mol
Flash Point: 225.8±28.7 °C
Index of Refraction: 1.579
Molar Refractivity: 82.2±0.4 cm3
#H bond acceptors: 4
#H bond donors: 0
#Freely Rotating Bonds: 3
#Rule of 5 Violations: 0
ACD/LogP: 0.79
ACD/LogD (pH 5.5): 0.60
ACD/BCF (pH 5.5): 1.13
ACD/KOC (pH 5.5): 24.04
ACD/LogD (pH 7.4): 1.27
ACD/BCF (pH 7.4): 5.42
ACD/KOC (pH 7.4): 115.03
Polar Surface Area: 65 Å2
Polarizability: 32.6±0.5 10-24cm3
Surface Tension: 53.1±5.0 dyne/cm
Molar Volume: 247.2±5.0 cm3

Click to predict properties on the Chemicalize site


Advertisement