ChemSpider 2D Image | (3S,6S)-3-Benzyl-3,6-dihydroxy-6-isobutyl-2,5-piperazinedione | C15H20N2O4

(3S,6S)-3-Benzyl-3,6-dihydroxy-6-isobutyl-2,5-piperazinedione

  • Molecular FormulaC15H20N2O4
  • Average mass292.330 Da
  • Monoisotopic mass292.142303 Da
  • ChemSpider ID78441404

  • defined stereocentres - 2 of 2 defined stereocentres

More details:

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

(3S,6S)-3-Benzyl-3,6-dihydroxy-6-isobutyl-2,5-piperazindion [German] [ACD/IUPAC Name]
(3S,6S)-3-Benzyl-3,6-dihydroxy-6-isobutyl-2,5-piperazinedione [ACD/IUPAC Name]
(3S,6S)-3-Benzyl-3,6-dihydroxy-6-isobutyl-2,5-pipérazinedione [French] [ACD/IUPAC Name]
2,5-Piperazinedione, 3,6-dihydroxy-3-(2-methylpropyl)-6-(phenylmethyl)-, (3S,6S)- [ACD/Index Name]
Lepistamide B

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

Density: 1.3±0.1 g/cm3
Boiling Point: 614.6±55.0 °C at 760 mmHg
Vapour Pressure: 0.0±1.9 mmHg at 25°C
Enthalpy of Vaporization: 95.9±3.0 kJ/mol
Flash Point: 325.5±31.5 °C
Index of Refraction: 1.571
Molar Refractivity: 76.1±0.3 cm3
#H bond acceptors: 6
#H bond donors: 4
#Freely Rotating Bonds: 4
#Rule of 5 Violations: 0
ACD/LogP: 1.01
ACD/LogD (pH 5.5): 0.88
ACD/BCF (pH 5.5): 2.74
ACD/KOC (pH 5.5): 71.53
ACD/LogD (pH 7.4): 0.88
ACD/BCF (pH 7.4): 2.73
ACD/KOC (pH 7.4): 71.45
Polar Surface Area: 99 Å2
Polarizability: 30.2±0.5 10-24cm3
Surface Tension: 53.4±3.0 dyne/cm
Molar Volume: 231.6±3.0 cm3

Click to predict properties on the Chemicalize site


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