ChemSpider 2D Image | N~2~-[(2S)-2-({[(1R)-1-Amino-3-phenylpropyl](hydroxy)phosphoryl}methyl)-4-methylpentanoyl]-L-serinamide | C19H32N3O5P

N2-[(2S)-2-({[(1R)-1-Amino-3-phenylpropyl](hydroxy)phosphoryl}methyl)-4-methylpentanoyl]-L-serinamide

  • Molecular FormulaC19H32N3O5P
  • Average mass413.448 Da
  • Monoisotopic mass413.207947 Da
  • ChemSpider ID76788885

  • defined stereocentres - 3 of 3 defined stereocentres

More details:

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

N2-[(2S)-2-({[(1R)-1-Amino-3-phenylpropyl](hydroxy)phosphoryl}methyl)-4-methylpentanoyl]-L-serinamid [German] [ACD/IUPAC Name]
N2-[(2S)-2-({[(1R)-1-Amino-3-phenylpropyl](hydroxy)phosphoryl}methyl)-4-methylpentanoyl]-L-serinamide [ACD/IUPAC Name]
N2-[(2S)-2-({[(1R)-1-Amino-3-phénylpropyl](hydroxy)phosphoryl}méthyl)-4-méthylpentanoyl]-L-sérinamide [French] [ACD/IUPAC Name]
Phosphinic acid, P-[(2S)-2-[[[(1S)-2-amino-1-(hydroxymethyl)-2-oxoethyl]amino]carbonyl]-4-methylpentyl]-P-[(1R)-1-amino-3-phenylpropyl]- [ACD/Index Name]

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

Density: 1.2±0.1 g/cm3
Boiling Point: 779.5±60.0 °C at 760 mmHg
Vapour Pressure: 0.0±2.8 mmHg at 25°C
Enthalpy of Vaporization: 119.0±3.0 kJ/mol
Flash Point: 425.2±32.9 °C
Index of Refraction: 1.554
Molar Refractivity: 107.3±0.3 cm3
#H bond acceptors: 8
#H bond donors: 7
#Freely Rotating Bonds: 12
#Rule of 5 Violations: 1
ACD/LogP: 1.61
ACD/LogD (pH 5.5): -2.02
ACD/BCF (pH 5.5): 1.00
ACD/KOC (pH 5.5): 1.00
ACD/LogD (pH 7.4): -2.03
ACD/BCF (pH 7.4): 1.00
ACD/KOC (pH 7.4): 1.00
Polar Surface Area: 166 Å2
Polarizability: 42.5±0.5 10-24cm3
Surface Tension: 55.2±3.0 dyne/cm
Molar Volume: 334.9±3.0 cm3

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