Found 1 result

Search term: SPPAWRHLLTTWGQ-SQNIBIBYSA-N (Found by InChIKey (full match))
ChemSpider 2D Image | (2S,3R)-N~4~-[(2S)-1-Amino-6-carbamimidamido-1-oxo-2-hexanyl]-N~1~,2-dihydroxy-3-(2-naphthylmethyl)succinamide | C22H30N6O5

(2S,3R)-N4-[(2S)-1-Amino-6-carbamimidamido-1-oxo-2-hexanyl]-N1,2-dihydroxy-3-(2-naphthylmethyl)succinamide

  • Molecular FormulaC22H30N6O5
  • Average mass458.511 Da
  • Monoisotopic mass458.227783 Da
  • ChemSpider ID29413461

  • defined stereocentres - 3 of 3 defined stereocentres

More details:

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

(2S,3R)-N4-[(2S)-1-Amino-6-carbamimidamido-1-oxo-2-hexanyl]-N1,2-dihydroxy-3-(2-naphthylmethyl)succinamid [German] [ACD/IUPAC Name]
(2S,3R)-N4-[(2S)-1-Amino-6-carbamimidamido-1-oxo-2-hexanyl]-N1,2-dihydroxy-3-(2-naphthylmethyl)succinamide [ACD/IUPAC Name]
(2S,3R)-N4-[(2S)-1-Amino-6-carbamimidamido-1-oxo-2-hexanyl]-N1,2-dihydroxy-3-(2-naphtylméthyl)succinamide [French] [ACD/IUPAC Name]
Butanediamide, N4-[(1S)-1-(aminocarbonyl)-5-[(aminoiminomethyl)amino]pentyl]-N1,2-dihydroxy-3-(2-naphthalenylmethyl)-, (2S,3R)- [ACD/Index Name]

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: 1.658
Molar Refractivity: 118.0±0.5 cm3
#H bond acceptors: 11
#H bond donors: 10
#Freely Rotating Bonds: 13
#Rule of 5 Violations: 2
ACD/LogP: -1.18
ACD/LogD (pH 5.5): -2.86
ACD/BCF (pH 5.5): 1.00
ACD/KOC (pH 5.5): 1.00
ACD/LogD (pH 7.4): -2.87
ACD/BCF (pH 7.4): 1.00
ACD/KOC (pH 7.4): 1.00
Polar Surface Area: 204 Å2
Polarizability: 46.8±0.5 10-24cm3
Surface Tension: 63.3±7.0 dyne/cm
Molar Volume: 320.2±7.0 cm3

Click to predict properties on the Chemicalize site


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