ChemSpider 2D Image | N~2~-[(S)-({[(Benzyloxy)carbonyl]amino}methyl)(hydroxy)phosphoryl]-N-(2,2-dimethylpropyl)-L-leucinamide | C20H34N3O5P

N2-[(S)-({[(Benzyloxy)carbonyl]amino}methyl)(hydroxy)phosphoryl]-N-(2,2-dimethylpropyl)-L-leucinamide

  • Molecular FormulaC20H34N3O5P
  • Average mass427.475 Da
  • Monoisotopic mass427.223602 Da
  • ChemSpider ID35034834

  • defined stereocentres - 1 of 1 defined stereocentres

More details:

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

Carbamic acid, N-[[(S)-[[(1S)-1-[[(2,2-dimethylpropyl)amino]carbonyl]-3-methylbutyl]amino]hydroxyphosphinyl]methyl]-, phenylmethyl ester [ACD/Index Name]
N2-[(S)-({[(Benzyloxy)carbonyl]amino}methyl)(hydroxy)phosphoryl]-N-(2,2-dimethylpropyl)-L-leucinamid [German] [ACD/IUPAC Name]
N2-[(S)-({[(Benzyloxy)carbonyl]amino}methyl)(hydroxy)phosphoryl]-N-(2,2-dimethylpropyl)-L-leucinamide [ACD/IUPAC Name]
N2-[(S)-({[(Benzyloxy)carbonyl]amino}méthyl)(hydroxy)phosphoryl]-N-(2,2-diméthylpropyl)-L-leucinamide [French] [ACD/IUPAC Name]
P-((((Benzyloxy)carbonyl)amino)methyl)-N-((S)-4-Methyl-1-(Neopentylamino)-1-Oxopentan-2-Yl)phosphonamidic Acid
2GZ

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

Density: 1.2±0.1 g/cm3
Boiling Point:
Vapour Pressure:
Enthalpy of Vaporization:
Flash Point:
Index of Refraction: 1.519
Molar Refractivity: 112.3±0.3 cm3
#H bond acceptors: 8
#H bond donors: 4
#Freely Rotating Bonds: 12
#Rule of 5 Violations: 0
ACD/LogP: 2.28
ACD/LogD (pH 5.5): -0.38
ACD/BCF (pH 5.5): 1.00
ACD/KOC (pH 5.5): 1.56
ACD/LogD (pH 7.4): -1.63
ACD/BCF (pH 7.4): 1.00
ACD/KOC (pH 7.4): 1.00
Polar Surface Area: 127 Å2
Polarizability: 44.5±0.5 10-24cm3
Surface Tension: 44.2±3.0 dyne/cm
Molar Volume: 369.8±3.0 cm3

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