ChemSpider 2D Image | N-(2-Naphthoyl)-L-valyl-N-{4-[(methylsulfonyl)amino]-1,4-dioxo-2-butanyl}-L-prolinamide | C26H32N4O7S

N-(2-Naphthoyl)-L-valyl-N-{4-[(methylsulfonyl)amino]-1,4-dioxo-2-butanyl}-L-prolinamide

  • Molecular FormulaC26H32N4O7S
  • Average mass544.620 Da
  • Monoisotopic mass544.199158 Da
  • ChemSpider ID23198182
  • defined stereocentres - 2 of 3 defined stereocentres


More details:






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

L-Prolinamide, N-(2-naphthalenylcarbonyl)-L-valyl-N-[1-formyl-3-[(methylsulfonyl)amino]-3-oxopropyl]- [ACD/Index Name]
N-(2-Naphthoyl)-L-valyl-N-{4-[(methylsulfonyl)amino]-1,4-dioxo-2-butanyl}-L-prolinamid [German] [ACD/IUPAC Name]
N-(2-Naphthoyl)-L-valyl-N-{4-[(methylsulfonyl)amino]-1,4-dioxo-2-butanyl}-L-prolinamide [ACD/IUPAC Name]
N-(2-Naphtoyl)-L-valyl-N-{4-[(méthylsulfonyl)amino]-1,4-dioxo-2-butanyl}-L-prolinamide [French] [ACD/IUPAC Name]
N-(naphthalen-2-ylcarbonyl)-L-valyl-N-{4-[(methylsulfonyl)amino]-1,4-dioxobutan-2-yl}-L-prolinamide
1-{3-Methyl-2-[(naphthalene-2-carbonyl)-amino]-butyryl}-pyrrolidine-2-carboxylic acid (1-formyl-3-methanesulfonylamino-3-oxo-propyl)-amide
CHEMBL114830

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: 1.601
Molar Refractivity: 140.7±0.4 cm3
#H bond acceptors: 11
#H bond donors: 3
#Freely Rotating Bonds: 10
#Rule of 5 Violations: 2
ACD/LogP: 1.59
ACD/LogD (pH 5.5): -0.06
ACD/BCF (pH 5.5): 1.00
ACD/KOC (pH 5.5): 5.69
ACD/LogD (pH 7.4): -0.75
ACD/BCF (pH 7.4): 1.00
ACD/KOC (pH 7.4): 1.17
Polar Surface Area: 167 Å2
Polarizability: 55.8±0.5 10-24cm3
Surface Tension: 57.7±3.0 dyne/cm
Molar Volume: 410.9±3.0 cm3

Click to predict properties on the Chemicalize site






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