ChemSpider 2D Image | N-{4-[(2-Amino-6-ethyl-4-oxo-1,4-dihydrothieno[2,3-d]pyrimidin-5-yl)sulfanyl]benzoyl}-L-glutamic acid | C20H20N4O6S2

N-{4-[(2-Amino-6-ethyl-4-oxo-1,4-dihydrothieno[2,3-d]pyrimidin-5-yl)sulfanyl]benzoyl}-L-glutamic acid

  • Molecular FormulaC20H20N4O6S2
  • Average mass476.526 Da
  • Monoisotopic mass476.082428 Da
  • ChemSpider ID24618910

  • defined stereocentres - 1 of 1 defined stereocentres

More details:

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

Acide N-{4-[(2-amino-6-éthyl-4-oxo-1,4-dihydrothiéno[2,3-d]pyrimidin-5-yl)sulfanyl]benzoyl}-L-glutamique [French] [ACD/IUPAC Name]
L-Glutamic acid, N-[4-[(2-amino-6-ethyl-3,4-dihydro-4-oxothieno[2,3-d]pyrimidin-5-yl)thio]benzoyl]- [ACD/Index Name]
N-({4-[(2-Amino-6-Ethyl-4-Oxo-3,4-Dihydrothieno[2,3-D]pyrimidin-5-Yl)sulfanyl]phenyl}carbonyl)-L-Glutamic Acid
N-{4-[(2-Amino-6-ethyl-4-oxo-1,4-dihydrothieno[2,3-d]pyrimidin-5-yl)sulfanyl]benzoyl}-L-glutamic acid [ACD/IUPAC Name]
N-{4-[(2-Amino-6-ethyl-4-oxo-1,4-dihydrothieno[2,3-d]pyrimidin-5-yl)sulfanyl]benzoyl}-L-glutaminsäure [German] [ACD/IUPAC Name]
GHC

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

Density: 1.6±0.1 g/cm3
Boiling Point:
Vapour Pressure:
Enthalpy of Vaporization:
Flash Point:
Index of Refraction: 1.750
Molar Refractivity: 118.7±0.5 cm3
#H bond acceptors: 10
#H bond donors: 6
#Freely Rotating Bonds: 9
#Rule of 5 Violations: 2
ACD/LogP: 1.54
ACD/LogD (pH 5.5): -1.90
ACD/BCF (pH 5.5): 1.00
ACD/KOC (pH 5.5): 1.00
ACD/LogD (pH 7.4): -3.63
ACD/BCF (pH 7.4): 1.00
ACD/KOC (pH 7.4): 1.00
Polar Surface Area: 225 Å2
Polarizability: 47.1±0.5 10-24cm3
Surface Tension: 73.7±7.0 dyne/cm
Molar Volume: 291.5±7.0 cm3

Click to predict properties on the Chemicalize site


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