ChemSpider 2D Image | Ethyl 4-(4-cyclohexyl-5,8-difluoro-1,1-dioxido-3,4-dihydro-2H-pyrido[4,3-b][1,4]thiazin-7-yl)-1-piperazinecarboxylate | C20H28F2N4O4S

Ethyl 4-(4-cyclohexyl-5,8-difluoro-1,1-dioxido-3,4-dihydro-2H-pyrido[4,3-b][1,4]thiazin-7-yl)-1-piperazinecarboxylate

  • Molecular FormulaC20H28F2N4O4S
  • Average mass458.522 Da
  • Monoisotopic mass458.179932 Da
  • ChemSpider ID22466718

More details:

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

1-Piperazinecarboxylic acid, 4-(4-cyclohexyl-5,8-difluoro-3,4-dihydro-1,1-dioxido-2H-pyrido[4,3-b]-1,4-thiazin-7-yl)-, ethyl ester [ACD/Index Name]
4-(4-Cyclohexyl-5,8-difluoro-1,1-dioxydo-3,4-dihydro-2H-pyrido[4,3-b][1,4]thiazin-7-yl)-1-pipérazinecarboxylate d'éthyle [French] [ACD/IUPAC Name]
Ethyl 4-(4-cyclohexyl-5,8-difluoro-1,1-dioxido-3,4-dihydro-2H-pyrido[4,3-b][1,4]thiazin-7-yl)-1-piperazinecarboxylate [ACD/IUPAC Name]
Ethyl-4-(4-cyclohexyl-5,8-difluor-1,1-dioxido-3,4-dihydro-2H-pyrido[4,3-b][1,4]thiazin-7-yl)-1-piperazincarboxylat [German] [ACD/IUPAC 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: 674.1±55.0 °C at 760 mmHg
Vapour Pressure: 0.0±2.1 mmHg at 25°C
Enthalpy of Vaporization: 99.0±3.0 kJ/mol
Flash Point: 361.5±31.5 °C
Index of Refraction: 1.577
Molar Refractivity: 110.4±0.4 cm3
#H bond acceptors: 8
#H bond donors: 0
#Freely Rotating Bonds: 4
#Rule of 5 Violations: 0
ACD/LogP: 2.41
ACD/LogD (pH 5.5): 2.56
ACD/BCF (pH 5.5): 51.59
ACD/KOC (pH 5.5): 585.40
ACD/LogD (pH 7.4): 2.56
ACD/BCF (pH 7.4): 51.59
ACD/KOC (pH 7.4): 585.40
Polar Surface Area: 91 Å2
Polarizability: 43.8±0.5 10-24cm3
Surface Tension: 54.5±3.0 dyne/cm
Molar Volume: 333.1±3.0 cm3

Click to predict properties on the Chemicalize site


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