ChemSpider 2D Image | 5-{[4-(Methylsulfonyl)-1-piperazinyl]carbonyl}-4-(2-thienylmethyl)-3-morpholinone | C15H21N3O5S2

5-{[4-(Methylsulfonyl)-1-piperazinyl]carbonyl}-4-(2-thienylmethyl)-3-morpholinone

  • Molecular FormulaC15H21N3O5S2
  • Average mass387.474 Da
  • Monoisotopic mass387.092255 Da
  • ChemSpider ID30754071

More details:

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

3-Morpholinone, 5-[[4-(methylsulfonyl)-1-piperazinyl]carbonyl]-4-(2-thienylmethyl)- [ACD/Index Name]
5-{[4-(Methylsulfonyl)-1-piperazinyl]carbonyl}-4-(2-thienylmethyl)-3-morpholinon [German] [ACD/IUPAC Name]
5-{[4-(Methylsulfonyl)-1-piperazinyl]carbonyl}-4-(2-thienylmethyl)-3-morpholinone [ACD/IUPAC Name]
5-{[4-(Méthylsulfonyl)-1-pipérazinyl]carbonyl}-4-(2-thiénylméthyl)-3-morpholinone [French] [ACD/IUPAC Name]
1421443-59-5 [RN]
5-(4-(methylsulfonyl)piperazine-1-carbonyl)-4-(thiophen-2-ylmethyl)morpholin-3-one
5-(4-METHANESULFONYLPIPERAZINE-1-CARBONYL)-4-(THIOPHEN-2-YLMETHYL)MORPHOLIN-3-ONE
5-(4-METHANESULFONYLPIPERAZINE-1-CARBONYL)-4-[(THIOPHEN-2-YL)METHYL]MORPHOLIN-3-ONE

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

Density: 1.5±0.1 g/cm3
Boiling Point: 666.6±65.0 °C at 760 mmHg
Vapour Pressure: 0.0±2.0 mmHg at 25°C
Enthalpy of Vaporization: 98.0±3.0 kJ/mol
Flash Point: 356.9±34.3 °C
Index of Refraction: 1.637
Molar Refractivity: 94.2±0.4 cm3
#H bond acceptors: 8
#H bond donors: 0
#Freely Rotating Bonds: 4
#Rule of 5 Violations: 0
ACD/LogP: -0.14
ACD/LogD (pH 5.5): 0.16
ACD/BCF (pH 5.5): 1.00
ACD/KOC (pH 5.5): 29.23
ACD/LogD (pH 7.4): 0.16
ACD/BCF (pH 7.4): 1.00
ACD/KOC (pH 7.4): 29.23
Polar Surface Area: 124 Å2
Polarizability: 37.3±0.5 10-24cm3
Surface Tension: 69.6±5.0 dyne/cm
Molar Volume: 262.3±5.0 cm3

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