ChemSpider 2D Image | 5-{2-[1-(Tert-Butoxycarbonyl)-2,3-Dihydro-1h-Indol-5-Yl]ethyl}-2,6-Dioxo-1,2,3,6-Tetrahydropyrimidine-4-Carboxylic Acid | C20H23N3O6

5-{2-[1-(Tert-Butoxycarbonyl)-2,3-Dihydro-1h-Indol-5-Yl]ethyl}-2,6-Dioxo-1,2,3,6-Tetrahydropyrimidine-4-Carboxylic Acid

  • Molecular FormulaC20H23N3O6
  • Average mass401.413 Da
  • Monoisotopic mass401.158691 Da
  • ChemSpider ID35034565

More details:

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

1H-Indole-1-carboxylic acid, 5-[2-(6-carboxy-1,2,3,4-tetrahydro-2,4-dioxo-5-pyrimidinyl)ethyl]-2,3-dihydro-, 1-(1,1-dimethylethyl) ester [ACD/Index Name]
5-[2-(1-{[(2-Methyl-2-propanyl)oxy]carbonyl}-2,3-dihydro-1H-indol-5-yl)ethyl]-2,6-dioxo-1,2,3,6-tetrahydro-4-pyrimidincarbonsäure [German] [ACD/IUPAC Name]
5-[2-(1-{[(2-Methyl-2-propanyl)oxy]carbonyl}-2,3-dihydro-1H-indol-5-yl)ethyl]-2,6-dioxo-1,2,3,6-tetrahydro-4-pyrimidinecarboxylic acid [ACD/IUPAC Name]
5-{2-[1-(Tert-Butoxycarbonyl)-2,3-Dihydro-1h-Indol-5-Yl]ethyl}-2,6-Dioxo-1,2,3,6-Tetrahydropyrimidine-4-Carboxylic Acid
Acide 5-[2-(1-{[(2-méthyl-2-propanyl)oxy]carbonyl}-2,3-dihydro-1H-indol-5-yl)éthyl]-2,6-dioxo-1,2,3,6-tétrahydro-4-pyrimidinecarboxylique [French] [ACD/IUPAC Name]
W7Q

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: 1.591
Molar Refractivity: 100.9±0.3 cm3
#H bond acceptors: 9
#H bond donors: 3
#Freely Rotating Bonds: 6
#Rule of 5 Violations: 0
ACD/LogP: 3.19
ACD/LogD (pH 5.5): -0.11
ACD/BCF (pH 5.5): 1.00
ACD/KOC (pH 5.5): 1.22
ACD/LogD (pH 7.4): -1.12
ACD/BCF (pH 7.4): 1.00
ACD/KOC (pH 7.4): 1.00
Polar Surface Area: 125 Å2
Polarizability: 40.0±0.5 10-24cm3
Surface Tension: 56.7±3.0 dyne/cm
Molar Volume: 298.7±3.0 cm3

Click to predict properties on the Chemicalize site


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