ChemSpider 2D Image | PPI-1019 | C36H54N6O5

PPI-1019

  • Molecular FormulaC36H54N6O5
  • Average mass650.851 Da
  • Monoisotopic mass650.415588 Da
  • ChemSpider ID8006703

  • defined stereocentres - 5 of 5 defined stereocentres

More details:

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

290828-45-4 [RN]
2F25P9Y22O
D-Leucinamide, N-methyl-D-leucyl-D-valyl-D-phenylalanyl-D-phenylalanyl- [ACD/Index Name]
N-Methyl-D-leucyl-D-valyl-D-phenylalanyl-D-phenylalanyl-D-leucinamid [German] [ACD/IUPAC Name]
N-Methyl-D-leucyl-D-valyl-D-phenylalanyl-D-phenylalanyl-D-leucinamide [ACD/IUPAC Name]
N-Méthyl-D-leucyl-D-valyl-D-phénylalanyl-D-phénylalanyl-D-leucinamide [French] [ACD/IUPAC Name]
PPI-1019
(2R)-4-methyl-2-[[(2R)-2-[[(2R)-2-[[(2R)-3-methyl-2-[[(2R)-4-methyl-2-(methylamino)pentanoyl]amino]butanoyl]amino]-3-phenylpropanoyl]amino]-3-phenylpropanoyl]amino]pentanamide
Apan
UNII:2F25P9Y22O

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

Density: 1.1±0.1 g/cm3
Boiling Point: 955.7±65.0 °C at 760 mmHg
Vapour Pressure: 0.0±0.3 mmHg at 25°C
Enthalpy of Vaporization: 139.3±3.0 kJ/mol
Flash Point: 531.8±34.3 °C
Index of Refraction: 1.543
Molar Refractivity: 183.5±0.3 cm3
#H bond acceptors: 11
#H bond donors: 7
#Freely Rotating Bonds: 19
#Rule of 5 Violations: 3
ACD/LogP: 4.97
ACD/LogD (pH 5.5): 0.54
ACD/BCF (pH 5.5): 1.00
ACD/KOC (pH 5.5): 2.59
ACD/LogD (pH 7.4): 2.15
ACD/BCF (pH 7.4): 13.39
ACD/KOC (pH 7.4): 104.72
Polar Surface Area: 172 Å2
Polarizability: 72.8±0.5 10-24cm3
Surface Tension: 44.5±3.0 dyne/cm
Molar Volume: 582.5±3.0 cm3

Click to predict properties on the Chemicalize site


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