Found 12 results

Search term: MF = 'C_{30}H_{51}N_{5}O_{9}'
ChemSpider 2D Image | N-{[(2-Methyl-2-propanyl)oxy]carbonyl}-3-({[(2-methyl-2-propanyl)oxy]carbonyl}amino)-L-alanyl-N-{(2S,3E)-5-ethoxy-5-oxo-1-[(3S)-2-oxo-3-pyrrolidinyl]-3-penten-2-yl}-L-leucinamide | C30H51N5O9

N-{[(2-Methyl-2-propanyl)oxy]carbonyl}-3-({[(2-methyl-2-propanyl)oxy]carbonyl}amino)-L-alanyl-N-{(2S,3E)-5-ethoxy-5-oxo-1-[(3S)-2-oxo-3-pyrrolidinyl]-3-penten-2-yl}-L-leucinamide

  • Molecular FormulaC30H51N5O9
  • Average mass625.754 Da
  • Monoisotopic mass625.368652 Da
  • ChemSpider ID9506005

  • Double-bond stereo - Double-bond stereo

    defined stereocentres - 4 of 4 defined stereocentres

More details:

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

L-Leucinamide, N-[(1,1-dimethylethoxy)carbonyl]-3-[[(1,1-dimethylethoxy)carbonyl]amino]-L-alanyl-N-[(1S,2E)-4-ethoxy-4-oxo-1-[[(3S)-2-oxo-3-pyrrolidinyl]methyl]-2-buten-1-yl]- [ACD/Index Name]
N-{[(2-Methyl-2-propanyl)oxy]carbonyl}-3-({[(2-methyl-2-propanyl)oxy]carbonyl}amino)-L-alanyl-N-{(2S,3E)-5-ethoxy-5-oxo-1-[(3S)-2-oxo-3-pyrrolidinyl]-3-penten-2-yl}-L-leucinamid [German] [ACD/IUPAC Name]
N-{[(2-Methyl-2-propanyl)oxy]carbonyl}-3-({[(2-methyl-2-propanyl)oxy]carbonyl}amino)-L-alanyl-N-{(2S,3E)-5-ethoxy-5-oxo-1-[(3S)-2-oxo-3-pyrrolidinyl]-3-penten-2-yl}-L-leucinamide [ACD/IUPAC Name]
N-{[(2-Méthyl-2-propanyl)oxy]carbonyl}-3-({[(2-méthyl-2-propanyl)oxy]carbonyl}amino)-L-alanyl-N-{(2S,3E)-5-éthoxy-5-oxo-1-[(3S)-2-oxo-3-pyrrolidinyl]-3-pentén-2-yl}-L-leucinamide [French] [ACD/IUPAC Name]

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

Density: 1.1±0.1 g/cm3
Boiling Point: 857.4±65.0 °C at 760 mmHg
Vapour Pressure: 0.0±3.2 mmHg at 25°C
Enthalpy of Vaporization: 124.6±3.0 kJ/mol
Flash Point: 472.4±34.3 °C
Index of Refraction: 1.501
Molar Refractivity: 162.0±0.3 cm3
#H bond acceptors: 14
#H bond donors: 5
#Freely Rotating Bonds: 19
#Rule of 5 Violations: 3
ACD/LogP: 3.33
ACD/LogD (pH 5.5): 2.61
ACD/BCF (pH 5.5): 56.66
ACD/KOC (pH 5.5): 625.65
ACD/LogD (pH 7.4): 2.61
ACD/BCF (pH 7.4): 56.64
ACD/KOC (pH 7.4): 625.47
Polar Surface Area: 190 Å2
Polarizability: 64.2±0.5 10-24cm3
Surface Tension: 42.6±3.0 dyne/cm
Molar Volume: 550.1±3.0 cm3

Click to predict properties on the Chemicalize site


Advertisement