ChemSpider 2D Image | N-[(2S,3R)-1-Hydroxy-3-methyl-2-pentanyl]-3-{(4S)-1-[2-(4-methoxyphenyl)ethyl]-2,5-dioxo-4-imidazolidinyl}propanamide | C21H31N3O5

N-[(2S,3R)-1-Hydroxy-3-methyl-2-pentanyl]-3-{(4S)-1-[2-(4-methoxyphenyl)ethyl]-2,5-dioxo-4-imidazolidinyl}propanamide

  • Molecular FormulaC21H31N3O5
  • Average mass405.488 Da
  • Monoisotopic mass405.226379 Da
  • ChemSpider ID32510177
  • defined stereocentres - 3 of 3 defined stereocentres


More details:






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

4-Imidazolidinepropanamide, N-[(1S,2R)-1-(hydroxymethyl)-2-methylbutyl]-1-[2-(4-methoxyphenyl)ethyl]-2,5-dioxo-, (4S)- [ACD/Index Name]
N-[(2S,3R)-1-Hydroxy-3-methyl-2-pentanyl]-3-{(4S)-1-[2-(4-methoxyphenyl)ethyl]-2,5-dioxo-4-imidazolidinyl}propanamid [German] [ACD/IUPAC Name]
N-[(2S,3R)-1-Hydroxy-3-methyl-2-pentanyl]-3-{(4S)-1-[2-(4-methoxyphenyl)ethyl]-2,5-dioxo-4-imidazolidinyl}propanamide [ACD/IUPAC Name]
N-[(2S,3R)-1-Hydroxy-3-méthyl-2-pentanyl]-3-{(4S)-1-[2-(4-méthoxyphényl)éthyl]-2,5-dioxo-4-imidazolidinyl}propanamide [French] [ACD/IUPAC Name]
C21H31N3O5
N-[(2S,3R)-1-hydroxy-3-methylpentan-2-yl]-3-[(4S)-1-[2-(4-methoxyphenyl)ethyl]-2,5-dioxoimidazolidin-4-yl]propanamide

Predicted data is generated using the ACD/Labs Percepta Platform - PhysChem Module

Density: 1.2±0.1 g/cm3
Boiling Point:
Vapour Pressure:
Enthalpy of Vaporization:
Flash Point:
Index of Refraction: 1.534
Molar Refractivity: 108.3±0.3 cm3
#H bond acceptors: 8
#H bond donors: 3
#Freely Rotating Bonds: 11
#Rule of 5 Violations: 0
ACD/LogP: 1.12
ACD/LogD (pH 5.5): 1.64
ACD/BCF (pH 5.5): 10.37
ACD/KOC (pH 5.5): 185.56
ACD/LogD (pH 7.4): 1.59
ACD/BCF (pH 7.4): 9.27
ACD/KOC (pH 7.4): 165.92
Polar Surface Area: 108 Å2
Polarizability: 42.9±0.5 10-24cm3
Surface Tension: 45.1±3.0 dyne/cm
Molar Volume: 348.4±3.0 cm3

Click to predict properties on the Chemicalize site






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