ChemSpider 2D Image | N-(1,1-Dioxidotetrahydro-3-thiophenyl)-N-methyl-2-[4-(2-pyrimidinyl)-1-piperazinyl]propanamide | C16H25N5O3S

N-(1,1-Dioxidotetrahydro-3-thiophenyl)-N-methyl-2-[4-(2-pyrimidinyl)-1-piperazinyl]propanamide

  • Molecular FormulaC16H25N5O3S
  • Average mass367.466 Da
  • Monoisotopic mass367.167816 Da
  • ChemSpider ID22478311

More details:

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

1-Piperazineacetamide, N,α-dimethyl-4-(2-pyrimidinyl)-N-(tetrahydro-1,1-dioxido-3-thienyl)- [ACD/Index Name]
N-(1,1-Dioxidotetrahydro-3-thiophenyl)-N-methyl-2-[4-(2-pyrimidinyl)-1-piperazinyl]propanamid [German] [ACD/IUPAC Name]
N-(1,1-Dioxidotetrahydro-3-thiophenyl)-N-methyl-2-[4-(2-pyrimidinyl)-1-piperazinyl]propanamide [ACD/IUPAC Name]
N-(1,1-Dioxydotétrahydro-3-thiophényl)-N-méthyl-2-[4-(2-pyrimidinyl)-1-pipérazinyl]propanamide [French] [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: 624.9±65.0 °C at 760 mmHg
Vapour Pressure: 0.0±1.8 mmHg at 25°C
Enthalpy of Vaporization: 92.5±3.0 kJ/mol
Flash Point: 331.7±34.3 °C
Index of Refraction: 1.611
Molar Refractivity: 94.4±0.4 cm3
#H bond acceptors: 8
#H bond donors: 0
#Freely Rotating Bonds: 4
#Rule of 5 Violations: 0
ACD/LogP: -0.29
ACD/LogD (pH 5.5): -0.35
ACD/BCF (pH 5.5): 1.00
ACD/KOC (pH 5.5): 13.30
ACD/LogD (pH 7.4): -0.21
ACD/BCF (pH 7.4): 1.00
ACD/KOC (pH 7.4): 18.32
Polar Surface Area: 95 Å2
Polarizability: 37.4±0.5 10-24cm3
Surface Tension: 66.7±5.0 dyne/cm
Molar Volume: 271.7±5.0 cm3

Click to predict properties on the Chemicalize site


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