ChemSpider 2D Image | N~2~-[(Benzyloxy)carbonyl]-N-[(2S)-1-oxo-3-(2-oxo-3-pyrrolidinyl)-2-propanyl]-L-leucinamide | C21H29N3O5

N2-[(Benzyloxy)carbonyl]-N-[(2S)-1-oxo-3-(2-oxo-3-pyrrolidinyl)-2-propanyl]-L-leucinamide

  • Molecular FormulaC21H29N3O5
  • Average mass403.472 Da
  • Monoisotopic mass403.210724 Da
  • ChemSpider ID26617691

  • defined stereocentres - 2 of 3 defined stereocentres

More details:

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

1333231-44-9 [RN]
Carbamic acid, N-[(1S)-1-[[[(1S)-1-formyl-2-(2-oxo-3-pyrrolidinyl)ethyl]amino]carbonyl]-3-methylbutyl]-, phenylmethyl ester [ACD/Index Name]
N2-[(Benzyloxy)carbonyl]-N-[(2S)-1-oxo-3-(2-oxo-3-pyrrolidinyl)-2-propanyl]-L-leucinamid [German] [ACD/IUPAC Name]
N2-[(Benzyloxy)carbonyl]-N-[(2S)-1-oxo-3-(2-oxo-3-pyrrolidinyl)-2-propanyl]-L-leucinamide [ACD/IUPAC Name]
N2-[(Benzyloxy)carbonyl]-N-[(2S)-1-oxo-3-(2-oxo-3-pyrrolidinyl)-2-propanyl]-L-leucinamide [French] [ACD/IUPAC Name]
Benzyl N-[(2S)-4-methyl-1-oxo-1-[[(2S)-1-oxo-3-(2-oxopyrrolidin-3-yl)propan-2-yl]amino]pentan-2-yl]carbamate
CS-16924
GC-373
MFCD30748147

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

    Density: 1.2±0.1 g/cm3
    Boiling Point: 680.6±50.0 °C at 760 mmHg
    Vapour Pressure: 0.0±2.1 mmHg at 25°C
    Enthalpy of Vaporization: 99.9±3.0 kJ/mol
    Flash Point: 365.4±30.1 °C
    Index of Refraction: 1.530
    Molar Refractivity: 106.5±0.3 cm3
    #H bond acceptors: 8
    #H bond donors: 3
    #Freely Rotating Bonds: 11
    #Rule of 5 Violations: 0
    ACD/LogP: 1.13
    ACD/LogD (pH 5.5): 1.38
    ACD/BCF (pH 5.5): 6.57
    ACD/KOC (pH 5.5): 133.92
    ACD/LogD (pH 7.4): 1.38
    ACD/BCF (pH 7.4): 6.57
    ACD/KOC (pH 7.4): 133.87
    Polar Surface Area: 114 Å2
    Polarizability: 42.2±0.5 10-24cm3
    Surface Tension: 45.7±3.0 dyne/cm
    Molar Volume: 344.8±3.0 cm3

    Click to predict properties on the Chemicalize site


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