Found 4 results

Search term: JDXUSWQJCGTBLN (Found by InChIKey (skeleton match))
ChemSpider 2D Image | N-(tert-butoxycarbonyl)-D-phenylalanyl-N-{5-[(diaminomethylidene)amino]-1-oxopentan-2-yl}-L-prolinamide | C25H38N6O5

N-(tert-butoxycarbonyl)-D-phenylalanyl-N-{5-[(diaminomethylidene)amino]-1-oxopentan-2-yl}-L-prolinamide

  • Molecular FormulaC25H38N6O5
  • Average mass502.606 Da
  • Monoisotopic mass502.290375 Da
  • ChemSpider ID19992712

  • defined stereocentres - 2 of 3 defined stereocentres

More details:

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

L-Prolinamide, N-((1,1-dimethylethoxy)carbonyl)-D-phenylalanyl-N-(4-((aminoiminomethyl)amino)-1-formylbutyl)-, (S)-
L-Prolinamide, N-[(1,1-dimethylethoxy)carbonyl]-D-phenylalanyl-N-[4-[(aminoiminomethyl)amino]-1-formylbutyl]- [ACD/Index Name]
N-(tert-butoxycarbonyl)-D-phenylalanyl-N-{5-[(diaminomethylidene)amino]-1-oxopentan-2-yl}-L-prolinamide
N-{[(2-Methyl-2-propanyl)oxy]carbonyl}-D-phenylalanyl-N-(5-carbamimidamido-1-oxo-2-pentanyl)-L-prolinamid [German] [ACD/IUPAC Name]
N-{[(2-Methyl-2-propanyl)oxy]carbonyl}-D-phenylalanyl-N-(5-carbamimidamido-1-oxo-2-pentanyl)-L-prolinamide [ACD/IUPAC Name]
N-{[(2-Méthyl-2-propanyl)oxy]carbonyl}-D-phénylalanyl-N-(5-carbamimidamido-1-oxo-2-pentanyl)-L-prolinamide [French] [ACD/IUPAC Name]
{1-Benzyl-2-[2-(1-formyl-4-guanidino-butylcarbamoyl)-pyrrolidin-1-yl]-2-oxo-ethyl}-carbamic acid tert-butyl ester

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: 1.597
Molar Refractivity: 134.4±0.5 cm3
#H bond acceptors: 11
#H bond donors: 6
#Freely Rotating Bonds: 14
#Rule of 5 Violations: 3
ACD/LogP: 1.52
ACD/LogD (pH 5.5): -0.65
ACD/BCF (pH 5.5): 1.00
ACD/KOC (pH 5.5): 1.29
ACD/LogD (pH 7.4): -0.65
ACD/BCF (pH 7.4): 1.00
ACD/KOC (pH 7.4): 1.30
Polar Surface Area: 167 Å2
Polarizability: 53.3±0.5 10-24cm3
Surface Tension: 50.6±7.0 dyne/cm
Molar Volume: 394.4±7.0 cm3

Click to predict properties on the Chemicalize site


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