ChemSpider 2D Image | 3-Cyclohexyl-N-isonicotinoyl-L-alanyl-L-arginyl-L-phenylalaninamide | C30H42N8O4

3-Cyclohexyl-N-isonicotinoyl-L-alanyl-L-arginyl-L-phenylalaninamide

  • Molecular FormulaC30H42N8O4
  • Average mass578.706 Da
  • Monoisotopic mass578.332886 Da
  • ChemSpider ID23128928

  • defined stereocentres - 3 of 3 defined stereocentres

More details:

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

3-cyclohexyl-N-(pyridin-4-ylcarbonyl)-L-alanyl-L-arginyl-L-phenylalaninamide
3-Cyclohexyl-N-isonicotinoyl-L-alanyl-L-arginyl-L-phenylalaninamid [German] [ACD/IUPAC Name]
3-Cyclohexyl-N-isonicotinoyl-L-alanyl-L-arginyl-L-phenylalaninamide [ACD/IUPAC Name]
3-Cyclohexyl-N-isonicotinoyl-L-alanyl-L-arginyl-L-phénylalaninamide [French] [ACD/IUPAC Name]
L-Phenylalaninamide, 3-cyclohexyl-N-(4-pyridinylcarbonyl)-L-alanyl-L-arginyl- [ACD/Index Name]
CHEMBL33781
N-{(S)-1-[(S)-1-((S)-1-Carbamoyl-2-phenyl-ethylcarbamoyl)-4-guanidino-butylcarbamoyl]-2-cyclohexyl-ethyl}-isonicotinamide

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

Density: 1.3±0.1 g/cm3
Boiling Point:
Vapour Pressure:
Enthalpy of Vaporization:
Flash Point:
Index of Refraction: 1.650
Molar Refractivity: 157.6±0.5 cm3
#H bond acceptors: 12
#H bond donors: 9
#Freely Rotating Bonds: 16
#Rule of 5 Violations: 3
ACD/LogP: 1.81
ACD/LogD (pH 5.5): -0.81
ACD/BCF (pH 5.5): 1.00
ACD/KOC (pH 5.5): 1.05
ACD/LogD (pH 7.4): -0.81
ACD/BCF (pH 7.4): 1.00
ACD/KOC (pH 7.4): 1.07
Polar Surface Area: 205 Å2
Polarizability: 62.5±0.5 10-24cm3
Surface Tension: 57.8±7.0 dyne/cm
Molar Volume: 432.1±7.0 cm3

Click to predict properties on the Chemicalize site


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