ChemSpider 2D Image | (4S)-4-{[N~5~-(N-Nitrocarbamimidoyl)-D-ornithyl]amino}-D-prolinamide | C11H22N8O4

(4S)-4-{[N5-(N-Nitrocarbamimidoyl)-D-ornithyl]amino}-D-prolinamide

  • Molecular FormulaC11H22N8O4
  • Average mass330.344 Da
  • Monoisotopic mass330.176392 Da
  • ChemSpider ID25051100

  • defined stereocentres - 3 of 3 defined stereocentres

More details:

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

(4S)-4-{[N5-(N-Nitrocarbamimidoyl)-D-ornithyl]amino}-D-prolinamid [German] [ACD/IUPAC Name]
(4S)-4-{[N5-(N-Nitrocarbamimidoyl)-D-ornithyl]amino}-D-prolinamide [ACD/IUPAC Name]
(4S)-4-{[N5-(N-Nitrocarbamimidoyl)-D-ornithyl]amino}-D-prolinamide [French] [ACD/IUPAC Name]
2-Pyrrolidinecarboxamide, 4-[[(2R)-2-amino-5-[[imino(nitroamino)methyl]amino]-1-oxopentyl]amino]-, (2R,4S)- [ACD/Index Name]

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

Density: 1.7±0.1 g/cm3
Boiling Point:
Vapour Pressure:
Enthalpy of Vaporization:
Flash Point:
Index of Refraction: 1.731
Molar Refractivity: 76.0±0.5 cm3
#H bond acceptors: 12
#H bond donors: 9
#Freely Rotating Bonds: 10
#Rule of 5 Violations: 2
ACD/LogP: -3.81
ACD/LogD (pH 5.5): -7.00
ACD/BCF (pH 5.5): 1.00
ACD/KOC (pH 5.5): 1.00
ACD/LogD (pH 7.4): -6.08
ACD/BCF (pH 7.4): 1.00
ACD/KOC (pH 7.4): 1.00
Polar Surface Area: 204 Å2
Polarizability: 30.1±0.5 10-24cm3
Surface Tension: 87.2±7.0 dyne/cm
Molar Volume: 190.3±7.0 cm3

Click to predict properties on the Chemicalize site


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