ChemSpider 2D Image | N,N-Diisobutylglycyl-L-valyl-L-isoleucyl-L-phenylalanyl-N~1~-(1-carboxypropyl)-L-aspartamide | C38H63N7O8

N,N-Diisobutylglycyl-L-valyl-L-isoleucyl-L-phenylalanyl-N1-(1-carboxypropyl)-L-aspartamide

  • Molecular FormulaC38H63N7O8
  • Average mass745.949 Da
  • Monoisotopic mass745.473816 Da
  • ChemSpider ID427332
  • defined stereocentres - 5 of 6 defined stereocentres


More details:






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

L-Aspartamide, N,N-bis(2-methylpropyl)glycyl-L-valyl-L-isoleucyl-L-phenylalanyl-N1-(1-carboxypropyl)- [ACD/Index Name]
N,N-Diisobutylglycyl-L-valyl-L-isoleucyl-L-phenylalanyl-N1-(1-carboxypropyl)-L-aspartamid [German] [ACD/IUPAC Name]
N,N-Diisobutylglycyl-L-valyl-L-isoleucyl-L-phenylalanyl-N1-(1-carboxypropyl)-L-aspartamide [ACD/IUPAC Name]
N,N-Diisobutylglycyl-L-valyl-L-isoleucyl-L-phénylalanyl-N1-(1-carboxypropyl)-L-aspartamide [French] [ACD/IUPAC Name]
(iBu)2NCH2C(=O)-VIFN-(±)Abu
L-Aspartamide, N,N-bis(2-methylpropyl)glycyl-L-valyl-L-isoleucyl-L-phenylalanyl-N1-(1-carboxypropyl)-

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

AIDS110054 [DBID]
AIDS-110054 [DBID]

Predicted data is generated using the ACD/Labs Percepta Platform - PhysChem Module

Density: 1.1±0.1 g/cm3
Boiling Point: 1059.4±65.0 °C at 760 mmHg
Vapour Pressure: 0.0±0.3 mmHg at 25°C
Enthalpy of Vaporization: 162.5±3.0 kJ/mol
Flash Point: 594.5±34.3 °C
Index of Refraction: 1.529
Molar Refractivity: 201.4±0.3 cm3
#H bond acceptors: 15
#H bond donors: 8
#Freely Rotating Bonds: 24
#Rule of 5 Violations: 4
ACD/LogP: 5.35
ACD/LogD (pH 5.5): 0.41
ACD/BCF (pH 5.5): 1.00
ACD/KOC (pH 5.5): 2.85
ACD/LogD (pH 7.4): 0.09
ACD/BCF (pH 7.4): 1.00
ACD/KOC (pH 7.4): 1.37
Polar Surface Area: 229 Å2
Polarizability: 79.8±0.5 10-24cm3
Surface Tension: 45.9±3.0 dyne/cm
Molar Volume: 653.2±3.0 cm3

Click to predict properties on the Chemicalize site






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