ChemSpider 2D Image | 2-Amino-N-{[(2R,3S,4R)-5-(2,4-dioxo-3,4-dihydro-1(2H)-pyrimidinyl)-3,4-dihydroxytetrahydro-2-furanyl]methyl}-3-(5-hydroxy-1H-indol-3-yl)propanamide | C20H23N5O7

2-Amino-N-{[(2R,3S,4R)-5-(2,4-dioxo-3,4-dihydro-1(2H)-pyrimidinyl)-3,4-dihydroxytetrahydro-2-furanyl]methyl}-3-(5-hydroxy-1H-indol-3-yl)propanamide

  • Molecular FormulaC20H23N5O7
  • Average mass445.426 Da
  • Monoisotopic mass445.159760 Da
  • ChemSpider ID24654933

  • defined stereocentres - 3 of 5 defined stereocentres

More details:

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

2,4(1H,3H)-Pyrimidinedione, 1-[5-[[2-amino-3-(5-hydroxy-1H-indol-3-yl)-1-oxopropyl]amino]-5-deoxy-D-ribofuranosyl]- [ACD/Index Name]
2-Amino-N-{[(2R,3S,4R)-5-(2,4-dioxo-3,4-dihydro-1(2H)-pyrimidinyl)-3,4-dihydroxytetrahydro-2-furanyl]methyl}-3-(5-hydroxy-1H-indol-3-yl)propanamid [German] [ACD/IUPAC Name]
2-Amino-N-{[(2R,3S,4R)-5-(2,4-dioxo-3,4-dihydro-1(2H)-pyrimidinyl)-3,4-dihydroxytetrahydro-2-furanyl]methyl}-3-(5-hydroxy-1H-indol-3-yl)propanamide [ACD/IUPAC Name]
2-Amino-N-{[(2R,3S,4R)-5-(2,4-dioxo-3,4-dihydro-1(2H)-pyrimidinyl)-3,4-dihydroxytétrahydro-2-furanyl]méthyl}-3-(5-hydroxy-1H-indol-3-yl)propanamide [French] [ACD/IUPAC Name]

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: 1.724
Molar Refractivity: 110.9±0.3 cm3
#H bond acceptors: 12
#H bond donors: 8
#Freely Rotating Bonds: 6
#Rule of 5 Violations: 2
ACD/LogP: -2.33
ACD/LogD (pH 5.5): -3.84
ACD/BCF (pH 5.5): 1.00
ACD/KOC (pH 5.5): 1.00
ACD/LogD (pH 7.4): -2.34
ACD/BCF (pH 7.4): 1.00
ACD/KOC (pH 7.4): 1.00
Polar Surface Area: 190 Å2
Polarizability: 43.9±0.5 10-24cm3
Surface Tension: 92.7±3.0 dyne/cm
Molar Volume: 279.4±3.0 cm3

Click to predict properties on the Chemicalize site


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