ChemSpider 2D Image | 2-{[2-Methoxy-5-(4-morpholinylsulfonyl)phenyl]amino}-2-oxoethyl 2-cyano-3-(2,5-dimethyl-1-propyl-1H-pyrrol-3-yl)acrylate | C26H32N4O7S

2-{[2-Methoxy-5-(4-morpholinylsulfonyl)phenyl]amino}-2-oxoethyl 2-cyano-3-(2,5-dimethyl-1-propyl-1H-pyrrol-3-yl)acrylate

  • Molecular FormulaC26H32N4O7S
  • Average mass544.620 Da
  • Monoisotopic mass544.199158 Da
  • ChemSpider ID30630298

More details:

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

2-{[2-Methoxy-5-(4-morpholinylsulfonyl)phenyl]amino}-2-oxoethyl 2-cyano-3-(2,5-dimethyl-1-propyl-1H-pyrrol-3-yl)acrylate [ACD/IUPAC Name]
2-{[2-Methoxy-5-(4-morpholinylsulfonyl)phenyl]amino}-2-oxoethyl-2-cyan-3-(2,5-dimethyl-1-propyl-1H-pyrrol-3-yl)acrylat [German] [ACD/IUPAC Name]
2-Cyano-3-(2,5-diméthyl-1-propyl-1H-pyrrol-3-yl)acrylate de 2-{[2-méthoxy-5-(4-morpholinylsulfonyl)phényl]amino}-2-oxoéthyle [French] [ACD/IUPAC Name]
2-Propenoic acid, 2-cyano-3-(2,5-dimethyl-1-propyl-1H-pyrrol-3-yl)-, 2-[[2-methoxy-5-(4-morpholinylsulfonyl)phenyl]amino]-2-oxoethyl ester [ACD/Index Name]

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: 1.596
Molar Refractivity: 142.5±0.5 cm3
#H bond acceptors: 11
#H bond donors: 1
#Freely Rotating Bonds: 12
#Rule of 5 Violations: 2
ACD/LogP: 3.22
ACD/LogD (pH 5.5): 3.27
ACD/BCF (pH 5.5): 181.12
ACD/KOC (pH 5.5): 1438.32
ACD/LogD (pH 7.4): 3.27
ACD/BCF (pH 7.4): 181.09
ACD/KOC (pH 7.4): 1438.06
Polar Surface Area: 148 Å2
Polarizability: 56.5±0.5 10-24cm3
Surface Tension: 49.1±7.0 dyne/cm
Molar Volume: 418.9±7.0 cm3

Click to predict properties on the Chemicalize site


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