ChemSpider 2D Image | 1-(Mesitylsulfonyl)-L-prolyl-4-[(5-carbamimidamidopentanoyl)amino]-L-phenylalanine | C29H40N6O6S

1-(Mesitylsulfonyl)-L-prolyl-4-[(5-carbamimidamidopentanoyl)amino]-L-phenylalanine

  • Molecular FormulaC29H40N6O6S
  • Average mass600.729 Da
  • Monoisotopic mass600.273010 Da
  • ChemSpider ID76822428

  • defined stereocentres - 2 of 2 defined stereocentres

More details:

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

1-(Mesitylsulfonyl)-L-prolyl-4-[(5-carbamimidamidopentanoyl)amino]-L-phenylalanin [German] [ACD/IUPAC Name]
1-(Mesitylsulfonyl)-L-prolyl-4-[(5-carbamimidamidopentanoyl)amino]-L-phenylalanine [ACD/IUPAC Name]
1-(Mésitylsulfonyl)-L-prolyl-4-[(5-carbamimidamidopentanoyl)amino]-L-phénylalanine [French] [ACD/IUPAC Name]
L-Phenylalanine, 1-[(2,4,6-trimethylphenyl)sulfonyl]-L-prolyl-4-[[5-[(aminoiminomethyl)amino]-1-oxopentyl]amino]- [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: 1.641
Molar Refractivity: 158.1±0.5 cm3
#H bond acceptors: 12
#H bond donors: 7
#Freely Rotating Bonds: 14
#Rule of 5 Violations: 3
ACD/LogP: 1.68
ACD/LogD (pH 5.5): -0.89
ACD/BCF (pH 5.5): 1.00
ACD/KOC (pH 5.5): 1.00
ACD/LogD (pH 7.4): -0.90
ACD/BCF (pH 7.4): 1.00
ACD/KOC (pH 7.4): 1.00
Polar Surface Area: 203 Å2
Polarizability: 62.7±0.5 10-24cm3
Surface Tension: 56.0±7.0 dyne/cm
Molar Volume: 438.3±7.0 cm3

Click to predict properties on the Chemicalize site


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