ChemSpider 2D Image | 3-(1H-Indol-3-yl)-2-({[1-(N-{[(2-methyl-2-propanyl)oxy]carbonyl}valyl)-4-piperidinyl]carbonyl}amino)propanoate | C27H37N4O6

3-(1H-Indol-3-yl)-2-({[1-(N-{[(2-methyl-2-propanyl)oxy]carbonyl}valyl)-4-piperidinyl]carbonyl}amino)propanoate

  • Molecular FormulaC27H37N4O6
  • Average mass513.606 Da
  • Monoisotopic mass513.271851 Da
  • ChemSpider ID24812795

  • Charge - Charge

More details:

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

3-(1H-Indol-3-yl)-2-({[1-(N-{[(2-methyl-2-propanyl)oxy]carbonyl}valyl)-4-piperidinyl]carbonyl}amino)propanoat [German] [ACD/IUPAC Name]
3-(1H-Indol-3-yl)-2-({[1-(N-{[(2-methyl-2-propanyl)oxy]carbonyl}valyl)-4-piperidinyl]carbonyl}amino)propanoate [ACD/IUPAC Name]
3-(1H-Indol-3-yl)-2-({[1-(N-{[(2-méthyl-2-propanyl)oxy]carbonyl}valyl)-4-pipéridinyl]carbonyl}amino)propanoate [French] [ACD/IUPAC Name]
Tryptophan, N-[[1-[2-[[(1,1-dimethylethoxy)carbonyl]amino]-3-methyl-1-oxobutyl]-4-piperidinyl]carbonyl]-, ion(1-) [ACD/Index Name]
ZINC15954465

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

Density:
Boiling Point: 795.0±60.0 °C at 760 mmHg
Vapour Pressure: 0.0±2.9 mmHg at 25°C
Enthalpy of Vaporization: 121.3±3.0 kJ/mol
Flash Point: 434.6±32.9 °C
Index of Refraction:
Molar Refractivity:
#H bond acceptors: 10
#H bond donors: 4
#Freely Rotating Bonds: 10
#Rule of 5 Violations: 2
ACD/LogP: 2.97
ACD/LogD (pH 5.5): 0.85
ACD/BCF (pH 5.5): 1.00
ACD/KOC (pH 5.5): 7.34
ACD/LogD (pH 7.4): -0.59
ACD/BCF (pH 7.4): 1.00
ACD/KOC (pH 7.4): 1.00
Polar Surface Area: 144 Å2
Polarizability:
Surface Tension:
Molar Volume:

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