ChemSpider 2D Image | N-[2-Amino-4-(L-tyrosylamino)butanoyl]glycyl-L-phenylalanyl-L-cysteinamide | C27H37N7O6S

N-[2-Amino-4-(L-tyrosylamino)butanoyl]glycyl-L-phenylalanyl-L-cysteinamide

  • Molecular FormulaC27H37N7O6S
  • Average mass587.691 Da
  • Monoisotopic mass587.252625 Da
  • ChemSpider ID8342812

  • defined stereocentres - 3 of 4 defined stereocentres

More details:

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

L-Cysteinamide, N-[2-amino-4-[[(2S)-2-amino-3-(4-hydroxyphenyl)-1-oxopropyl]amino]-1-oxobutyl]glycyl-L-phenylalanyl- [ACD/Index Name]
N-[2-Amino-4-(L-tyrosylamino)butanoyl]glycyl-L-phenylalanyl-L-cysteinamid [German] [ACD/IUPAC Name]
N-[2-Amino-4-(L-tyrosylamino)butanoyl]glycyl-L-phenylalanyl-L-cysteinamide [ACD/IUPAC Name]
N-[2-Amino-4-(L-tyrosylamino)butanoyl]glycyl-L-phénylalanyl-L-cystéinamide [French] [ACD/IUPAC Name]

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

Density: 1.3±0.1 g/cm3
Boiling Point: 1074.4±65.0 °C at 760 mmHg
Vapour Pressure: 0.0±0.3 mmHg at 25°C
Enthalpy of Vaporization: 163.0±3.0 kJ/mol
Flash Point: 603.6±34.3 °C
Index of Refraction: 1.618
Molar Refractivity: 155.3±0.3 cm3
#H bond acceptors: 13
#H bond donors: 11
#Freely Rotating Bonds: 16
#Rule of 5 Violations: 3
ACD/LogP: -0.07
ACD/LogD (pH 5.5): -4.69
ACD/BCF (pH 5.5): 1.00
ACD/KOC (pH 5.5): 1.00
ACD/LogD (pH 7.4): -1.67
ACD/BCF (pH 7.4): 1.00
ACD/KOC (pH 7.4): 1.72
Polar Surface Area: 271 Å2
Polarizability: 61.6±0.5 10-24cm3
Surface Tension: 63.9±3.0 dyne/cm
Molar Volume: 443.4±3.0 cm3

Click to predict properties on the Chemicalize site


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