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Search term: TZAPOJSPYZNJDT-FDFHNCONSA-N (Found by InChIKey (full match))
ChemSpider 2D Image | N-(tert-butoxycarbonyl)-D-phenylalanyl-L-leucyl-N-ethyl-L-norvalinamide | C27H44N4O5

N-(tert-butoxycarbonyl)-D-phenylalanyl-L-leucyl-N-ethyl-L-norvalinamide

  • Molecular FormulaC27H44N4O5
  • Average mass504.662 Da
  • Monoisotopic mass504.331177 Da
  • ChemSpider ID23186513

  • defined stereocentres - 3 of 3 defined stereocentres

More details:

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

L-Norvalinamide, N-[(1,1-dimethylethoxy)carbonyl]-D-phenylalanyl-L-leucyl-N-ethyl- [ACD/Index Name]
N-(tert-butoxycarbonyl)-D-phenylalanyl-L-leucyl-N-ethyl-L-norvalinamide
N-{[(2-Methyl-2-propanyl)oxy]carbonyl}-D-phenylalanyl-L-leucyl-N-ethyl-L-norvalinamid [German] [ACD/IUPAC Name]
N-{[(2-Methyl-2-propanyl)oxy]carbonyl}-D-phenylalanyl-L-leucyl-N-ethyl-L-norvalinamide [ACD/IUPAC Name]
N-{[(2-Méthyl-2-propanyl)oxy]carbonyl}-D-phénylalanyl-L-leucyl-N-éthyl-L-norvalinamide [French] [ACD/IUPAC Name]
{(R)-1-[(S)-1-((S)-1-Ethylcarbamoyl-butylcarbamoyl)-3-methyl-butylcarbamoyl]-2-phenyl-ethyl}-carbamic acid tert-butyl ester
https://www.ebi.ac.uk/chembl/compoundreportcard/CHEMBL327974/

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

Density: 1.1±0.1 g/cm3
Boiling Point: 761.8±60.0 °C at 760 mmHg
Vapour Pressure: 0.0±2.6 mmHg at 25°C
Enthalpy of Vaporization: 111.0±3.0 kJ/mol
Flash Point: 414.5±32.9 °C
Index of Refraction: 1.510
Molar Refractivity: 139.9±0.3 cm3
#H bond acceptors: 9
#H bond donors: 4
#Freely Rotating Bonds: 15
#Rule of 5 Violations: 2
ACD/LogP: 5.09
ACD/LogD (pH 5.5): 3.49
ACD/BCF (pH 5.5): 266.81
ACD/KOC (pH 5.5): 1897.94
ACD/LogD (pH 7.4): 3.49
ACD/BCF (pH 7.4): 266.74
ACD/KOC (pH 7.4): 1897.45
Polar Surface Area: 126 Å2
Polarizability: 55.4±0.5 10-24cm3
Surface Tension: 40.1±3.0 dyne/cm
Molar Volume: 467.5±3.0 cm3

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