ChemSpider 2D Image | (5-Ethyl-4,5,6,7-tetrahydro-1-benzothiophen-2-yl)[4-(methylsulfonyl)-1-piperazinyl]methanone | C16H24N2O3S2

(5-Ethyl-4,5,6,7-tetrahydro-1-benzothiophen-2-yl)[4-(methylsulfonyl)-1-piperazinyl]methanone

  • Molecular FormulaC16H24N2O3S2
  • Average mass356.503 Da
  • Monoisotopic mass356.122833 Da
  • ChemSpider ID21632889

More details:

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

(5-Ethyl-4,5,6,7-tetrahydro-1-benzothiophen-2-yl)[4-(methylsulfonyl)-1-piperazinyl]methanon [German] [ACD/IUPAC Name]
(5-Ethyl-4,5,6,7-tetrahydro-1-benzothiophen-2-yl)[4-(methylsulfonyl)-1-piperazinyl]methanone [ACD/IUPAC Name]
(5-Éthyl-4,5,6,7-tétrahydro-1-benzothiophén-2-yl)[4-(méthylsulfonyl)-1-pipérazinyl]méthanone [French] [ACD/IUPAC Name]
Methanone, (5-ethyl-4,5,6,7-tetrahydrobenzo[b]thien-2-yl)[4-(methylsulfonyl)-1-piperazinyl]- [ACD/Index Name]
(5-ethyl-4,5,6,7-tetrahydro-1-benzothiophen-2-yl)[4-(methylsulfonyl)piperazin-1-yl]methanone
(5-Ethyl-4,5,6,7-tetrahydro-benzo[b]thiophen-2-yl)-(4-methanesulfonyl-piperazin-1-yl)-methanone
1-[(5-ethyl-4,5,6,7-tetrahydro-1-benzothien-2-yl)carbonyl]-4-(methylsulfonyl)piperazine
MFCD09778094

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

Density: 1.3±0.1 g/cm3
Boiling Point: 563.1±60.0 °C at 760 mmHg
Vapour Pressure: 0.0±1.5 mmHg at 25°C
Enthalpy of Vaporization: 84.6±3.0 kJ/mol
Flash Point: 294.4±32.9 °C
Index of Refraction: 1.610
Molar Refractivity: 93.0±0.4 cm3
#H bond acceptors: 5
#H bond donors: 0
#Freely Rotating Bonds: 3
#Rule of 5 Violations: 0
ACD/LogP: 2.86
ACD/LogD (pH 5.5): 2.63
ACD/BCF (pH 5.5): 59.09
ACD/KOC (pH 5.5): 645.13
ACD/LogD (pH 7.4): 2.63
ACD/BCF (pH 7.4): 59.09
ACD/KOC (pH 7.4): 645.13
Polar Surface Area: 94 Å2
Polarizability: 36.9±0.5 10-24cm3
Surface Tension: 58.6±5.0 dyne/cm
Molar Volume: 268.3±5.0 cm3

Click to predict properties on the Chemicalize site


Advertisement