ChemSpider 2D Image | Ethyl {2-[(2,2-dimethylpropanoyl)amino]-4-oxo-4,7-dihydro-1H-pyrrolo[2,3-d]pyrimidin-6-yl}acetate | C15H20N4O4

Ethyl {2-[(2,2-dimethylpropanoyl)amino]-4-oxo-4,7-dihydro-1H-pyrrolo[2,3-d]pyrimidin-6-yl}acetate

  • Molecular FormulaC15H20N4O4
  • Average mass320.344 Da
  • Monoisotopic mass320.148468 Da
  • ChemSpider ID30653102

More details:

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

{2-[(2,2-Diméthylpropanoyl)amino]-4-oxo-4,7-dihydro-1H-pyrrolo[2,3-d]pyrimidin-6-yl}acétate d'éthyle [French] [ACD/IUPAC Name]
3H-Pyrrolo[2,3-d]pyrimidine-6-acetic acid, 2-[(2,2-dimethyl-1-oxopropyl)amino]-4,7-dihydro-4-oxo-, ethyl ester [ACD/Index Name]
Ethyl {2-[(2,2-dimethylpropanoyl)amino]-4-oxo-4,7-dihydro-1H-pyrrolo[2,3-d]pyrimidin-6-yl}acetate [ACD/IUPAC Name]
Ethyl-{2-[(2,2-dimethylpropanoyl)amino]-4-oxo-4,7-dihydro-1H-pyrrolo[2,3-d]pyrimidin-6-yl}acetat [German] [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: 1.616
Molar Refractivity: 82.5±0.5 cm3
#H bond acceptors: 8
#H bond donors: 3
#Freely Rotating Bonds: 6
#Rule of 5 Violations: 0
ACD/LogP: 1.59
ACD/LogD (pH 5.5): 1.47
ACD/BCF (pH 5.5): 7.65
ACD/KOC (pH 5.5): 149.38
ACD/LogD (pH 7.4): 1.47
ACD/BCF (pH 7.4): 7.65
ACD/KOC (pH 7.4): 149.28
Polar Surface Area: 113 Å2
Polarizability: 32.7±0.5 10-24cm3
Surface Tension: 48.7±7.0 dyne/cm
Molar Volume: 236.1±7.0 cm3

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