ChemSpider 2D Image | N-[({5-[(Allyloxy)carbonyl]-3-(ethoxycarbonyl)-4-methyl-2-thienyl}amino)(oxo)acetyl]serine | C17H20N2O9S

N-[({5-[(Allyloxy)carbonyl]-3-(ethoxycarbonyl)-4-methyl-2-thienyl}amino)(oxo)acetyl]serine

  • Molecular FormulaC17H20N2O9S
  • Average mass428.414 Da
  • Monoisotopic mass428.088959 Da
  • ChemSpider ID112694687

More details:

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

2,4-Thiophenedicarboxylic acid, 5-[[2-[(1-carboxy-2-hydroxyethyl)amino]-1,2-dioxoethyl]amino]-3-methyl-, 4-ethyl 2-(2-propen-1-yl) ester [ACD/Index Name]
N-[({5-[(Allyloxy)carbonyl]-3-(ethoxycarbonyl)-4-methyl-2-thienyl}amino)(oxo)acetyl]serin [German] [ACD/IUPAC Name]
N-[({5-[(Allyloxy)carbonyl]-3-(ethoxycarbonyl)-4-methyl-2-thienyl}amino)(oxo)acetyl]serine [ACD/IUPAC Name]
N-[2-({5-[(Allyloxy)carbonyl]-3-(éthoxycarbonyl)-4-méthyl-2-thiényl}amino)-2-oxoacétyl]sérine [French] [ACD/IUPAC 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: 1.600
Molar Refractivity: 101.5±0.3 cm3
#H bond acceptors: 11
#H bond donors: 4
#Freely Rotating Bonds: 12
#Rule of 5 Violations: 1
ACD/LogP: 3.32
ACD/LogD (pH 5.5): -0.89
ACD/BCF (pH 5.5): 1.00
ACD/KOC (pH 5.5): 1.00
ACD/LogD (pH 7.4): -1.69
ACD/BCF (pH 7.4): 1.00
ACD/KOC (pH 7.4): 1.00
Polar Surface Area: 197 Å2
Polarizability: 40.2±0.5 10-24cm3
Surface Tension: 63.7±3.0 dyne/cm
Molar Volume: 296.6±3.0 cm3

Click to predict properties on the Chemicalize site


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