ChemSpider 2D Image | [4-(5-Ethyl-1,3-thiazol-2-yl)-1-piperazinyl][5-methyl-1-(4-piperidinyl)-1H-1,2,3-triazol-4-yl]methanone | C18H27N7OS

[4-(5-Ethyl-1,3-thiazol-2-yl)-1-piperazinyl][5-methyl-1-(4-piperidinyl)-1H-1,2,3-triazol-4-yl]methanone

  • Molecular FormulaC18H27N7OS
  • Average mass389.518 Da
  • Monoisotopic mass389.199768 Da
  • ChemSpider ID63791135

More details:

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

[4-(5-Ethyl-1,3-thiazol-2-yl)-1-piperazinyl][5-methyl-1-(4-piperidinyl)-1H-1,2,3-triazol-4-yl]methanon [German] [ACD/IUPAC Name]
[4-(5-Ethyl-1,3-thiazol-2-yl)-1-piperazinyl][5-methyl-1-(4-piperidinyl)-1H-1,2,3-triazol-4-yl]methanone [ACD/IUPAC Name]
[4-(5-Éthyl-1,3-thiazol-2-yl)-1-pipérazinyl][5-méthyl-1-(4-pipéridinyl)-1H-1,2,3-triazol-4-yl]méthanone [French] [ACD/IUPAC Name]
Methanone, [4-(5-ethyl-2-thiazolyl)-1-piperazinyl][5-methyl-1-(4-piperidinyl)-1H-1,2,3-triazol-4-yl]- [ACD/Index Name]

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

Density: 1.4±0.1 g/cm3
Boiling Point: 625.6±65.0 °C at 760 mmHg
Vapour Pressure: 0.0±1.8 mmHg at 25°C
Enthalpy of Vaporization: 92.6±3.0 kJ/mol
Flash Point: 332.1±34.3 °C
Index of Refraction: 1.731
Molar Refractivity: 107.7±0.5 cm3
#H bond acceptors: 8
#H bond donors: 1
#Freely Rotating Bonds: 4
#Rule of 5 Violations: 0
ACD/LogP: -0.64
ACD/LogD (pH 5.5): -3.57
ACD/BCF (pH 5.5): 1.00
ACD/KOC (pH 5.5): 1.00
ACD/LogD (pH 7.4): -1.98
ACD/BCF (pH 7.4): 1.00
ACD/KOC (pH 7.4): 1.00
Polar Surface Area: 107 Å2
Polarizability: 42.7±0.5 10-24cm3
Surface Tension: 60.5±7.0 dyne/cm
Molar Volume: 269.5±7.0 cm3

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