ChemSpider 2D Image | N-[5-Fluoro-2-(1-piperidinyl)phenyl]-4-pyridinecarbothioamide | C17H18FN3S

N-[5-Fluoro-2-(1-piperidinyl)phenyl]-4-pyridinecarbothioamide

  • Molecular FormulaC17H18FN3S
  • Average mass315.408 Da
  • Monoisotopic mass315.120544 Da
  • ChemSpider ID35293714

More details:

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

1113044-49-7 [RN]
4-Pyridinecarbothioamide, N-[5-fluoro-2-(1-piperidinyl)phenyl]- [ACD/Index Name]
N-[5-Fluor-2-(1-piperidinyl)phenyl]-4-pyridincarbothioamid [German] [ACD/IUPAC Name]
N-[5-Fluoro-2-(1-piperidinyl)phenyl]-4-pyridinecarbothioamide [ACD/IUPAC Name]
N-[5-Fluoro-2-(1-pipéridinyl)phényl]-4-pyridinecarbothioamide [French] [ACD/IUPAC Name]
N-[5-fluoro-2-(piperidin-1-yl)phenyl]pyridine-4-carbothioamide
[1113044-49-7] [RN]
CID 25186688
FIT 039
FIT039
More...

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

Density: 1.3±0.1 g/cm3
Boiling Point: 460.4±55.0 °C at 760 mmHg
Vapour Pressure: 0.0±1.1 mmHg at 25°C
Enthalpy of Vaporization: 72.1±3.0 kJ/mol
Flash Point: 232.2±31.5 °C
Index of Refraction: 1.662
Molar Refractivity: 91.0±0.3 cm3
#H bond acceptors: 3
#H bond donors: 1
#Freely Rotating Bonds: 4
#Rule of 5 Violations: 0
ACD/LogP: 3.05
ACD/LogD (pH 5.5): 3.33
ACD/BCF (pH 5.5): 198.99
ACD/KOC (pH 5.5): 1526.38
ACD/LogD (pH 7.4): 3.34
ACD/BCF (pH 7.4): 201.51
ACD/KOC (pH 7.4): 1545.71
Polar Surface Area: 60 Å2
Polarizability: 36.1±0.5 10-24cm3
Surface Tension: 62.3±3.0 dyne/cm
Molar Volume: 245.9±3.0 cm3

Click to predict properties on the Chemicalize site


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