ChemSpider 2D Image | N-{[(2-Methyl-2-propanyl)oxy]carbonyl}-D-phenylalanyl-L-alanyl-N-(4-nitrophenyl)-L-norleucinamide | C29H39N5O7

N-{[(2-Methyl-2-propanyl)oxy]carbonyl}-D-phenylalanyl-L-alanyl-N-(4-nitrophenyl)-L-norleucinamide

  • Molecular FormulaC29H39N5O7
  • Average mass569.649 Da
  • Monoisotopic mass569.284973 Da
  • ChemSpider ID28296008

  • defined stereocentres - 3 of 3 defined stereocentres

More details:

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

L-Norleucinamide, N-[(1,1-dimethylethoxy)carbonyl]-D-phenylalanyl-L-alanyl-N-(4-nitrophenyl)- [ACD/Index Name]
N-{[(2-Methyl-2-propanyl)oxy]carbonyl}-D-phenylalanyl-L-alanyl-N-(4-nitrophenyl)-L-norleucinamid [German] [ACD/IUPAC Name]
N-{[(2-Methyl-2-propanyl)oxy]carbonyl}-D-phenylalanyl-L-alanyl-N-(4-nitrophenyl)-L-norleucinamide [ACD/IUPAC Name]
N-{[(2-Méthyl-2-propanyl)oxy]carbonyl}-D-phénylalanyl-L-alanyl-N-(4-nitrophényl)-L-norleucinamide [French] [ACD/IUPAC Name]
75935-65-8 [RN]
N-T-BOC-D-PHE-ALA-NLE P-NITROANILIDE
N-T-BOC-D-PHE-ALA-NLEP-NITROANILIDE
TERT-BUTYL N-[(1R)-1-{[(1S)-1-{[(1S)-1-[(4-NITROPHENYL)CARBAMOYL]PENTYL]CARBAMOYL}ETHYL]CARBAMOYL}-2-PHENYLETHYL]CARBAMATE

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

Density: 1.2±0.1 g/cm3
Boiling Point: 857.1±65.0 °C at 760 mmHg
Vapour Pressure: 0.0±3.2 mmHg at 25°C
Enthalpy of Vaporization: 124.6±3.0 kJ/mol
Flash Point: 472.2±34.3 °C
Index of Refraction: 1.570
Molar Refractivity: 153.5±0.3 cm3
#H bond acceptors: 12
#H bond donors: 4
#Freely Rotating Bonds: 15
#Rule of 5 Violations: 3
ACD/LogP: 6.18
ACD/LogD (pH 5.5): 3.65
ACD/BCF (pH 5.5): 348.51
ACD/KOC (pH 5.5): 2297.85
ACD/LogD (pH 7.4): 3.65
ACD/BCF (pH 7.4): 348.42
ACD/KOC (pH 7.4): 2297.22
Polar Surface Area: 171 Å2
Polarizability: 60.9±0.5 10-24cm3
Surface Tension: 49.5±3.0 dyne/cm
Molar Volume: 468.0±3.0 cm3

Click to predict properties on the Chemicalize site


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