ChemSpider 2D Image | N~2~-[{[3-(Ethoxycarbonyl)-5-(isobutoxycarbonyl)-4-methyl-2-thienyl]amino}(oxo)acetyl]glutamine | C20H27N3O9S

N2-[{[3-(Ethoxycarbonyl)-5-(isobutoxycarbonyl)-4-methyl-2-thienyl]amino}(oxo)acetyl]glutamine

  • Molecular FormulaC20H27N3O9S
  • Average mass485.508 Da
  • Monoisotopic mass485.146790 Da
  • ChemSpider ID112686427

More details:

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

2,4-Thiophenedicarboxylic acid, 5-[[2-[(4-amino-1-carboxy-4-oxobutyl)amino]-1,2-dioxoethyl]amino]-3-methyl-, 4-ethyl 2-(2-methylpropyl) ester [ACD/Index Name]
N2-(2-{[3-(Éthoxycarbonyl)-5-(isobutoxycarbonyl)-4-méthyl-2-thiényl]amino}-2-oxoacétyl)glutamine [French] [ACD/IUPAC Name]
N2-[{[3-(Ethoxycarbonyl)-5-(isobutoxycarbonyl)-4-methyl-2-thienyl]amino}(oxo)acetyl]glutamin [German] [ACD/IUPAC Name]
N2-[{[3-(Ethoxycarbonyl)-5-(isobutoxycarbonyl)-4-methyl-2-thienyl]amino}(oxo)acetyl]glutamine [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: 1.578
Molar Refractivity: 117.6±0.3 cm3
#H bond acceptors: 12
#H bond donors: 5
#Freely Rotating Bonds: 14
#Rule of 5 Violations: 2
ACD/LogP: 3.79
ACD/LogD (pH 5.5): -0.15
ACD/BCF (pH 5.5): 1.00
ACD/KOC (pH 5.5): 1.16
ACD/LogD (pH 7.4): -1.16
ACD/BCF (pH 7.4): 1.00
ACD/KOC (pH 7.4): 1.00
Polar Surface Area: 219 Å2
Polarizability: 46.6±0.5 10-24cm3
Surface Tension: 59.0±3.0 dyne/cm
Molar Volume: 354.7±3.0 cm3

Click to predict properties on the Chemicalize site


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