ChemSpider 2D Image | Methyl N-[(2-{[5-(1,3-dimethyl-1H-pyrazol-4-yl)-1,2-oxazol-3-yl]carbonyl}hydrazino)carbonyl]-4-fluorophenylalaninate | C20H21FN6O5

Methyl N-[(2-{[5-(1,3-dimethyl-1H-pyrazol-4-yl)-1,2-oxazol-3-yl]carbonyl}hydrazino)carbonyl]-4-fluorophenylalaninate

  • Molecular FormulaC20H21FN6O5
  • Average mass444.416 Da
  • Monoisotopic mass444.155731 Da
  • ChemSpider ID102135103

More details:

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

Methyl N-[(2-{[5-(1,3-dimethyl-1H-pyrazol-4-yl)-1,2-oxazol-3-yl]carbonyl}hydrazino)carbonyl]-4-fluorophenylalaninate [ACD/IUPAC Name]
Methyl-N-[(2-{[5-(1,3-dimethyl-1H-pyrazol-4-yl)-1,2-oxazol-3-yl]carbonyl}hydrazino)carbonyl]-4-fluorphenylalaninat [German] [ACD/IUPAC Name]
N-[(2-{[5-(1,3-Diméthyl-1H-pyrazol-4-yl)-1,2-oxazol-3-yl]carbonyl}hydrazino)carbonyl]-4-fluorophénylalaninate de méthyle [French] [ACD/IUPAC Name]
Phenylalanine, N-[[2-[[5-(1,3-dimethyl-1H-pyrazol-4-yl)-3-isoxazolyl]carbonyl]hydrazinyl]carbonyl]-4-fluoro-, methyl ester [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: 1.639
Molar Refractivity: 110.9±0.5 cm3
#H bond acceptors: 11
#H bond donors: 3
#Freely Rotating Bonds: 8
#Rule of 5 Violations: 1
ACD/LogP: 1.43
ACD/LogD (pH 5.5): 1.19
ACD/BCF (pH 5.5): 4.75
ACD/KOC (pH 5.5): 106.20
ACD/LogD (pH 7.4): 1.16
ACD/BCF (pH 7.4): 4.37
ACD/KOC (pH 7.4): 97.60
Polar Surface Area: 140 Å2
Polarizability: 44.0±0.5 10-24cm3
Surface Tension: 52.1±7.0 dyne/cm
Molar Volume: 308.2±7.0 cm3

Click to predict properties on the Chemicalize site


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