ChemSpider 2D Image | (2R,3S)-N~1~-(Benzyloxy)-N~4~-[(2S)-3,3-dimethyl-1-(methylamino)-1-oxo-2-butanyl]-2-hydroxy-3-isobutylsuccinamide | C22H35N3O5

(2R,3S)-N1-(Benzyloxy)-N4-[(2S)-3,3-dimethyl-1-(methylamino)-1-oxo-2-butanyl]-2-hydroxy-3-isobutylsuccinamide

  • Molecular FormulaC22H35N3O5
  • Average mass421.530 Da
  • Monoisotopic mass421.257660 Da
  • ChemSpider ID58790126

  • defined stereocentres - 3 of 3 defined stereocentres

More details:

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

(2R,3S)-N1-(Benzyloxy)-N4-[(2S)-3,3-dimethyl-1-(methylamino)-1-oxo-2-butanyl]-2-hydroxy-3-isobutylsuccinamid [German] [ACD/IUPAC Name]
(2R,3S)-N1-(Benzyloxy)-N4-[(2S)-3,3-dimethyl-1-(methylamino)-1-oxo-2-butanyl]-2-hydroxy-3-isobutylsuccinamide [ACD/IUPAC Name]
(2R,3S)-N1-(Benzyloxy)-N4-[(2S)-3,3-diméthyl-1-(méthylamino)-1-oxo-2-butanyl]-2-hydroxy-3-isobutylsuccinamide [French] [ACD/IUPAC Name]
Butanediamide, N4-[(1S)-2,2-dimethyl-1-[(methylamino)carbonyl]propyl]-2-hydroxy-3-(2-methylpropyl)-N1-(phenylmethoxy)-, (2R,3S)- [ACD/Index Name]
(2R,3S)-N1-(benzyloxy)-N4-((S)-3,3-dimethyl-1-(methylamino)-1-oxobutan-2-yl)-2-hydroxy-3-isobutylsuccinamide
2459945-84-5 [RN]
CS-17197

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

Density: 1.1±0.1 g/cm3
Boiling Point:
Vapour Pressure:
Enthalpy of Vaporization:
Flash Point:
Index of Refraction: 1.521
Molar Refractivity: 114.6±0.3 cm3
#H bond acceptors: 8
#H bond donors: 4
#Freely Rotating Bonds: 11
#Rule of 5 Violations: 0
ACD/LogP: 2.93
ACD/LogD (pH 5.5): 1.93
ACD/BCF (pH 5.5): 17.37
ACD/KOC (pH 5.5): 268.60
ACD/LogD (pH 7.4): 1.93
ACD/BCF (pH 7.4): 17.37
ACD/KOC (pH 7.4): 268.59
Polar Surface Area: 117 Å2
Polarizability: 45.4±0.5 10-24cm3
Surface Tension: 42.4±3.0 dyne/cm
Molar Volume: 376.6±3.0 cm3

Click to predict properties on the Chemicalize site


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