ChemSpider 2D Image | N-(Benzylsulfonyl)-D-valyl-N-(4-carbamimidoylbenzyl)-L-prolinamide | C25H33N5O4S

N-(Benzylsulfonyl)-D-valyl-N-(4-carbamimidoylbenzyl)-L-prolinamide

  • Molecular FormulaC25H33N5O4S
  • Average mass499.626 Da
  • Monoisotopic mass499.225311 Da
  • ChemSpider ID26612921

  • defined stereocentres - 2 of 2 defined stereocentres

More details:

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

L-Prolinamide, N-[(phenylmethyl)sulfonyl]-D-valyl-N-[[4-(aminoiminomethyl)phenyl]methyl]- [ACD/Index Name]
N-(Benzylsulfonyl)-D-valyl-N-(4-carbamimidoylbenzyl)-L-prolinamid [German] [ACD/IUPAC Name]
N-(Benzylsulfonyl)-D-valyl-N-(4-carbamimidoylbenzyl)-L-prolinamide [ACD/IUPAC Name]
N-(Benzylsulfonyl)-D-valyl-N-(4-carbamimidoylbenzyl)-L-prolinamide [French] [ACD/IUPAC Name]
S54

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: 1.638
Molar Refractivity: 135.1±0.5 cm3
#H bond acceptors: 9
#H bond donors: 5
#Freely Rotating Bonds: 10
#Rule of 5 Violations: 1
ACD/LogP: 1.35
ACD/LogD (pH 5.5): -0.03
ACD/BCF (pH 5.5): 1.00
ACD/KOC (pH 5.5): 2.81
ACD/LogD (pH 7.4): -0.04
ACD/BCF (pH 7.4): 1.00
ACD/KOC (pH 7.4): 2.78
Polar Surface Area: 154 Å2
Polarizability: 53.6±0.5 10-24cm3
Surface Tension: 54.3±7.0 dyne/cm
Molar Volume: 375.9±7.0 cm3

Click to predict properties on the Chemicalize site


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