ChemSpider 2D Image | 7-{2-[3-(2,4-Dioxo-1,3-oxazolidin-3-yl)-1-pyrrolidinyl]-2-oxoethyl}-1,3-dimethyl-3,7-dihydro-1H-purine-2,6-dione | C16H18N6O6

7-{2-[3-(2,4-Dioxo-1,3-oxazolidin-3-yl)-1-pyrrolidinyl]-2-oxoethyl}-1,3-dimethyl-3,7-dihydro-1H-purine-2,6-dione

  • Molecular FormulaC16H18N6O6
  • Average mass390.351 Da
  • Monoisotopic mass390.128784 Da
  • ChemSpider ID35012055

More details:

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

1H-Purine-2,6-dione, 7-[2-[3-(2,4-dioxo-3-oxazolidinyl)-1-pyrrolidinyl]-2-oxoethyl]-3,7-dihydro-1,3-dimethyl- [ACD/Index Name]
7-{2-[3-(2,4-Dioxo-1,3-oxazolidin-3-yl)-1-pyrrolidinyl]-2-oxoethyl}-1,3-dimethyl-3,7-dihydro-1H-purin-2,6-dion [German] [ACD/IUPAC Name]
7-{2-[3-(2,4-Dioxo-1,3-oxazolidin-3-yl)-1-pyrrolidinyl]-2-oxoethyl}-1,3-dimethyl-3,7-dihydro-1H-purine-2,6-dione [ACD/IUPAC Name]
7-{2-[3-(2,4-Dioxo-1,3-oxazolidin-3-yl)-1-pyrrolidinyl]-2-oxoéthyl}-1,3-diméthyl-3,7-dihydro-1H-purine-2,6-dione [French] [ACD/IUPAC Name]
2034297-86-2 [RN]
3-(1-(2-(1,3-dimethyl-2,6-dioxo-2,3-dihydro-1H-purin-7(6H)-yl)acetyl)pyrrolidin-3-yl)oxazolidine-2,4-dione
7-{2-[3-(2,4-dioxo-1,3-oxazolidin-3-yl)pyrrolidin-1-yl]-2-oxoethyl}-1,3-dimethyl-2,3,6,7-tetrahydro-1H-purine-2,6-dione

Predicted data is generated using the ACD/Labs Percepta Platform - PhysChem Module, version: 14.00

Density: 1.7±0.1 g/cm3
Boiling Point: 671.2±65.0 °C at 760 mmHg
Vapour Pressure: 0.0±2.1 mmHg at 25°C
Enthalpy of Vaporization: 98.6±3.0 kJ/mol
Flash Point: 359.7±34.3 °C
Index of Refraction: 1.774
Molar Refractivity: 94.2±0.5 cm3
#H bond acceptors: 12
#H bond donors: 0
#Freely Rotating Bonds: 3
#Rule of 5 Violations: 1
ACD/LogP: -1.32
ACD/LogD (pH 5.5): -0.81
ACD/BCF (pH 5.5): 1.00
ACD/KOC (pH 5.5): 8.69
ACD/LogD (pH 7.4): -0.81
ACD/BCF (pH 7.4): 1.00
ACD/KOC (pH 7.4): 8.69
Polar Surface Area: 125 Å2
Polarizability: 37.3±0.5 10-24cm3
Surface Tension: 80.2±7.0 dyne/cm
Molar Volume: 225.8±7.0 cm3

Click to predict properties on the Chemicalize site


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