ChemSpider 2D Image | N-(2-Amino-3-phenylpropanoyl)-1-(6-carbamimidamido-1-chloro-2-oxo-3-hexanyl)prolinamide | C21H31ClN6O3

N-(2-Amino-3-phenylpropanoyl)-1-(6-carbamimidamido-1-chloro-2-oxo-3-hexanyl)prolinamide

  • Molecular FormulaC21H31ClN6O3
  • Average mass450.962 Da
  • Monoisotopic mass450.214630 Da
  • ChemSpider ID28551043

More details:

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

2-Pyrrolidinecarboxamide, 1-[4-[(aminoiminomethyl)amino]-1-(2-chloroacetyl)butyl]-N-(2-amino-1-oxo-3-phenylpropyl)- [ACD/Index Name]
N-(2-Amino-3-phenylpropanoyl)-1-(6-carbamimidamido-1-chlor-2-oxo-3-hexanyl)prolinamid [German] [ACD/IUPAC Name]
N-(2-Amino-3-phenylpropanoyl)-1-(6-carbamimidamido-1-chloro-2-oxo-3-hexanyl)prolinamide [ACD/IUPAC Name]
N-(2-Amino-3-phénylpropanoyl)-1-(6-carbamimidamido-1-chloro-2-oxo-3-hexanyl)prolinamide [French] [ACD/IUPAC Name]
71142-71-7 [RN]
N-(2-amino-3-phenylpropanoyl)-1-[1-chloro-6-(diaminomethylideneamino)-2-oxohexan-3-yl]pyrrolidine-2-carboxamide
PPACK
PPACK DIHYDROCHLORIDE

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

Density: 1.4±0.1 g/cm3
Boiling Point:
Vapour Pressure:
Enthalpy of Vaporization:
Flash Point:
Index of Refraction: 1.641
Molar Refractivity: 117.2±0.5 cm3
#H bond acceptors: 9
#H bond donors: 7
#Freely Rotating Bonds: 11
#Rule of 5 Violations: 1
ACD/LogP: 0.59
ACD/LogD (pH 5.5): -2.59
ACD/BCF (pH 5.5): 1.00
ACD/KOC (pH 5.5): 1.00
ACD/LogD (pH 7.4): -1.64
ACD/BCF (pH 7.4): 1.00
ACD/KOC (pH 7.4): 1.00
Polar Surface Area: 157 Å2
Polarizability: 46.5±0.5 10-24cm3
Surface Tension: 57.9±7.0 dyne/cm
Molar Volume: 325.1±7.0 cm3

Click to predict properties on the Chemicalize site


Advertisement