ChemSpider 2D Image | N-(3-Phenylpropanoyl)-L-alpha-aspartyl-N-{(2S)-5-[(diaminomethylene)amino]-1-oxo-2-pentanyl}-D-prolinamide | C24H34N6O6

N-(3-Phenylpropanoyl)-L-α-aspartyl-N-{(2S)-5-[(diaminomethylene)amino]-1-oxo-2-pentanyl}-D-prolinamide

  • Molecular FormulaC24H34N6O6
  • Average mass502.563 Da
  • Monoisotopic mass502.253998 Da
  • ChemSpider ID8003136

  • defined stereocentres - 3 of 3 defined stereocentres

More details:

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

D-Prolinamide, N-(1-oxo-3-phenylpropyl)-L-α-aspartyl-N-[(1S)-4-[(diaminomethylene)amino]-1-formylbutyl]- [ACD/Index Name]
N-(3-Phenylpropanoyl)-L-α-asparagyl-N-{(2S)-5-[(diaminomethylen)amino]-1-oxo-2-pentanyl}-D-prolinamid [German] [ACD/IUPAC Name]
N-(3-Phenylpropanoyl)-L-α-aspartyl-N-{(2S)-5-[(diaminomethylene)amino]-1-oxo-2-pentanyl}-D-prolinamide [ACD/IUPAC Name]
N-(3-Phénylpropanoyl)-L-α-aspartyl-N-{(2S)-5-[(diaminométhylène)amino]-1-oxo-2-pentanyl}-D-prolinamide [French] [ACD/IUPAC Name]

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

Density: 1.4±0.1 g/cm3
Boiling Point:
Vapour Pressure:
Enthalpy of Vaporization:
Flash Point:
Index of Refraction: 1.635
Molar Refractivity: 130.1±0.5 cm3
#H bond acceptors: 12
#H bond donors: 7
#Freely Rotating Bonds: 14
#Rule of 5 Violations: 3
ACD/LogP: 1.63
ACD/LogD (pH 5.5): -2.11
ACD/BCF (pH 5.5): 1.00
ACD/KOC (pH 5.5): 1.00
ACD/LogD (pH 7.4): -2.17
ACD/BCF (pH 7.4): 1.00
ACD/KOC (pH 7.4): 1.00
Polar Surface Area: 197 Å2
Polarizability: 51.6±0.5 10-24cm3
Surface Tension: 60.3±7.0 dyne/cm
Molar Volume: 363.6±7.0 cm3

Click to predict properties on the Chemicalize site


Advertisement