ChemSpider 2D Image | N-[({3-(Ethoxycarbonyl)-5-[(2-methoxyethoxy)carbonyl]-4-methyl-2-thienyl}amino)(oxo)acetyl]valine | C19H26N2O9S

N-[({3-(Ethoxycarbonyl)-5-[(2-methoxyethoxy)carbonyl]-4-methyl-2-thienyl}amino)(oxo)acetyl]valine

  • Molecular FormulaC19H26N2O9S
  • Average mass458.483 Da
  • Monoisotopic mass458.135895 Da
  • ChemSpider ID112691973

More details:

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

2,4-Thiophenedicarboxylic acid, 5-[[2-[(1-carboxy-2-methylpropyl)amino]-1,2-dioxoethyl]amino]-3-methyl-, 4-ethyl 2-(2-methoxyethyl) ester [ACD/Index Name]
N-[({3-(Ethoxycarbonyl)-5-[(2-methoxyethoxy)carbonyl]-4-methyl-2-thienyl}amino)(oxo)acetyl]valin [German] [ACD/IUPAC Name]
N-[({3-(Ethoxycarbonyl)-5-[(2-methoxyethoxy)carbonyl]-4-methyl-2-thienyl}amino)(oxo)acetyl]valine [ACD/IUPAC Name]
N-[2-({3-(Éthoxycarbonyl)-5-[(2-méthoxyéthoxy)carbonyl]-4-méthyl-2-thiényl}amino)-2-oxoacétyl]valine [French] [ACD/IUPAC 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: 1.560
Molar Refractivity: 111.2±0.3 cm3
#H bond acceptors: 11
#H bond donors: 3
#Freely Rotating Bonds: 13
#Rule of 5 Violations: 1
ACD/LogP: 3.84
ACD/LogD (pH 5.5): 0.13
ACD/BCF (pH 5.5): 1.00
ACD/KOC (pH 5.5): 2.02
ACD/LogD (pH 7.4): -1.02
ACD/BCF (pH 7.4): 1.00
ACD/KOC (pH 7.4): 1.00
Polar Surface Area: 186 Å2
Polarizability: 44.1±0.5 10-24cm3
Surface Tension: 53.3±3.0 dyne/cm
Molar Volume: 343.8±3.0 cm3

Click to predict properties on the Chemicalize site


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