ChemSpider 2D Image | Methyl N-[(3-{[4-(2-ethoxyphenyl)-1-piperazinyl]sulfonyl}-1-ethyl-1H-pyrazol-4-yl)carbonyl]glycinate | C21H29N5O6S

Methyl N-[(3-{[4-(2-ethoxyphenyl)-1-piperazinyl]sulfonyl}-1-ethyl-1H-pyrazol-4-yl)carbonyl]glycinate

  • Molecular FormulaC21H29N5O6S
  • Average mass479.550 Da
  • Monoisotopic mass479.183868 Da
  • ChemSpider ID29126338

More details:

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

Glycine, N-[[3-[[4-(2-ethoxyphenyl)-1-piperazinyl]sulfonyl]-1-ethyl-1H-pyrazol-4-yl]carbonyl]-, methyl ester [ACD/Index Name]
Methyl N-[(3-{[4-(2-ethoxyphenyl)-1-piperazinyl]sulfonyl}-1-ethyl-1H-pyrazol-4-yl)carbonyl]glycinate [ACD/IUPAC Name]
Methyl-N-[(3-{[4-(2-ethoxyphenyl)-1-piperazinyl]sulfonyl}-1-ethyl-1H-pyrazol-4-yl)carbonyl]glycinat [German] [ACD/IUPAC Name]
N-[(3-{[4-(2-Éthoxyphényl)-1-pipérazinyl]sulfonyl}-1-éthyl-1H-pyrazol-4-yl)carbonyl]glycinate de méthyle [French] [ACD/IUPAC Name]
METHYL 2-({3-[4-(2-ETHOXYPHENYL)PIPERAZIN-1-YLSULFONYL]-1-ETHYLPYRAZOL-4-YL}FORMAMIDO)ACETATE
METHYL 2-[(3-{[4-(2-ETHOXYPHENYL)PIPERAZIN-1-YL]SULFONYL}-1-ETHYL-1H-PYRAZOL-4-YL)FORMAMIDO]ACETATE
N-[2-(3,4-dihydroquinolin-1(2H)-yl)-2-oxo-1-phenylethyl]-2,4-dimethoxybenzamide

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: 1.619
Molar Refractivity: 123.3±0.5 cm3
#H bond acceptors: 11
#H bond donors: 1
#Freely Rotating Bonds: 10
#Rule of 5 Violations: 1
ACD/LogP: 0.56
ACD/LogD (pH 5.5): 1.07
ACD/BCF (pH 5.5): 3.18
ACD/KOC (pH 5.5): 64.05
ACD/LogD (pH 7.4): 1.40
ACD/BCF (pH 7.4): 6.79
ACD/KOC (pH 7.4): 136.49
Polar Surface Area: 131 Å2
Polarizability: 48.9±0.5 10-24cm3
Surface Tension: 53.4±7.0 dyne/cm
Molar Volume: 351.8±7.0 cm3

Click to predict properties on the Chemicalize site


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