ChemSpider 2D Image | N-({2-[(1-{[(Benzyloxy)carbonyl]amino}-2-phenylethyl)(hydroxy)phosphoryl]cyclopentyl}carbonyl)tryptophan | C33H36N3O7P

N-({2-[(1-{[(Benzyloxy)carbonyl]amino}-2-phenylethyl)(hydroxy)phosphoryl]cyclopentyl}carbonyl)tryptophan

  • Molecular FormulaC33H36N3O7P
  • Average mass617.629 Da
  • Monoisotopic mass617.229065 Da
  • ChemSpider ID8136245

More details:

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

N-({2-[(1-{[(Benzyloxy)carbonyl]amino}-2-phenylethyl)(hydroxy)phosphoryl]cyclopentyl}carbonyl)tryptophan [ACD/IUPAC Name]
N-({2-[(1-{[(Benzyloxy)carbonyl]amino}-2-phenylethyl)(hydroxy)phosphoryl]cyclopentyl}carbonyl)tryptophan [German] [ACD/IUPAC Name]
N-({2-[(1-{[(Benzyloxy)carbonyl]amino}-2-phényléthyl)(hydroxy)phosphoryl]cyclopentyl}carbonyl)tryptophane [French] [ACD/IUPAC Name]
Tryptophan, N-[[2-[hydroxy[2-phenyl-1-[[(phenylmethoxy)carbonyl]amino]ethyl]phosphinyl]cyclopentyl]carbonyl]- [ACD/Index 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: 996.6±65.0 °C at 760 mmHg
Vapour Pressure: 0.0±0.3 mmHg at 25°C
Enthalpy of Vaporization: 152.3±3.0 kJ/mol
Flash Point: 556.5±34.3 °C
Index of Refraction: 1.658
Molar Refractivity: 164.9±0.4 cm3
#H bond acceptors: 10
#H bond donors: 5
#Freely Rotating Bonds: 13
#Rule of 5 Violations: 4
ACD/LogP: 5.06
ACD/LogD (pH 5.5): -0.44
ACD/BCF (pH 5.5): 1.00
ACD/KOC (pH 5.5): 1.00
ACD/LogD (pH 7.4): -0.78
ACD/BCF (pH 7.4): 1.00
ACD/KOC (pH 7.4): 1.00
Polar Surface Area: 168 Å2
Polarizability: 65.4±0.5 10-24cm3
Surface Tension: 70.6±5.0 dyne/cm
Molar Volume: 448.0±5.0 cm3

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