ChemSpider 2D Image | 2-Methyl-2-propanyl 4-({4-[(2,3,5,6-tetramethylphenyl)sulfonyl]-1-piperazinyl}carbonyl)-1-piperidinecarboxylate | C25H39N3O5S

2-Methyl-2-propanyl 4-({4-[(2,3,5,6-tetramethylphenyl)sulfonyl]-1-piperazinyl}carbonyl)-1-piperidinecarboxylate

  • Molecular FormulaC25H39N3O5S
  • Average mass493.659 Da
  • Monoisotopic mass493.261047 Da
  • ChemSpider ID21962793

More details:

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

1-Piperidinecarboxylic acid, 4-[[4-[(2,3,5,6-tetramethylphenyl)sulfonyl]-1-piperazinyl]carbonyl]-, 1,1-dimethylethyl ester [ACD/Index Name]
2-Methyl-2-propanyl 4-({4-[(2,3,5,6-tetramethylphenyl)sulfonyl]-1-piperazinyl}carbonyl)-1-piperidinecarboxylate [ACD/IUPAC Name]
2-Methyl-2-propanyl-4-({4-[(2,3,5,6-tetramethylphenyl)sulfonyl]-1-piperazinyl}carbonyl)-1-piperidincarboxylat [German] [ACD/IUPAC Name]
4-({4-[(2,3,5,6-Tétraméthylphényl)sulfonyl]-1-pipérazinyl}carbonyl)-1-pipéridinecarboxylate de 2-méthyl-2-propanyle [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: 659.2±65.0 °C at 760 mmHg
Vapour Pressure: 0.0±2.0 mmHg at 25°C
Enthalpy of Vaporization: 97.0±3.0 kJ/mol
Flash Point: 352.5±34.3 °C
Index of Refraction: 1.558
Molar Refractivity: 133.0±0.4 cm3
#H bond acceptors: 8
#H bond donors: 0
#Freely Rotating Bonds: 5
#Rule of 5 Violations: 0
ACD/LogP: 4.07
ACD/LogD (pH 5.5): 4.12
ACD/BCF (pH 5.5): 793.16
ACD/KOC (pH 5.5): 4139.63
ACD/LogD (pH 7.4): 4.12
ACD/BCF (pH 7.4): 793.16
ACD/KOC (pH 7.4): 4139.63
Polar Surface Area: 96 Å2
Polarizability: 52.7±0.5 10-24cm3
Surface Tension: 47.2±3.0 dyne/cm
Molar Volume: 412.9±3.0 cm3

Click to predict properties on the Chemicalize site


Advertisement