ChemSpider 2D Image | 3,3-Dimethyl-1-{4-[(4-methyl-1-piperazinyl)carbonyl]-1,3-thiazolidin-3-yl}-1-butanone | C15H27N3O2S

3,3-Dimethyl-1-{4-[(4-methyl-1-piperazinyl)carbonyl]-1,3-thiazolidin-3-yl}-1-butanone

  • Molecular FormulaC15H27N3O2S
  • Average mass313.459 Da
  • Monoisotopic mass313.182404 Da
  • ChemSpider ID30355230

More details:

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

1-Butanone, 3,3-dimethyl-1-[4-[(4-methyl-1-piperazinyl)carbonyl]-3-thiazolidinyl]- [ACD/Index Name]
3,3-Dimethyl-1-{4-[(4-methyl-1-piperazinyl)carbonyl]-1,3-thiazolidin-3-yl}-1-butanon [German] [ACD/IUPAC Name]
3,3-Dimethyl-1-{4-[(4-methyl-1-piperazinyl)carbonyl]-1,3-thiazolidin-3-yl}-1-butanone [ACD/IUPAC Name]
3,3-Diméthyl-1-{4-[(4-méthyl-1-pipérazinyl)carbonyl]-1,3-thiazolidin-3-yl}-1-butanone [French] [ACD/IUPAC Name]

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

Density: 1.2±0.1 g/cm3
Boiling Point: 500.6±50.0 °C at 760 mmHg
Vapour Pressure: 0.0±1.3 mmHg at 25°C
Enthalpy of Vaporization: 76.9±3.0 kJ/mol
Flash Point: 256.6±30.1 °C
Index of Refraction: 1.545
Molar Refractivity: 86.1±0.3 cm3
#H bond acceptors: 5
#H bond donors: 0
#Freely Rotating Bonds: 3
#Rule of 5 Violations: 0
ACD/LogP: 1.07
ACD/LogD (pH 5.5): -0.17
ACD/BCF (pH 5.5): 1.00
ACD/KOC (pH 5.5): 5.10
ACD/LogD (pH 7.4): 1.01
ACD/BCF (pH 7.4): 3.28
ACD/KOC (pH 7.4): 76.94
Polar Surface Area: 69 Å2
Polarizability: 34.1±0.5 10-24cm3
Surface Tension: 45.6±3.0 dyne/cm
Molar Volume: 272.5±3.0 cm3

Click to predict properties on the Chemicalize site


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