ChemSpider 2D Image | (5S)-6-[(2R,3S,4R,5R)-5-(6-Amino-9H-purin-9-yl)-3,4-dihydroxytetrahydro-2-furanyl]-5-(propylamino)-L-norleucine | C18H29N7O5

(5S)-6-[(2R,3S,4R,5R)-5-(6-Amino-9H-purin-9-yl)-3,4-dihydroxytetrahydro-2-furanyl]-5-(propylamino)-L-norleucine

  • Molecular FormulaC18H29N7O5
  • Average mass423.467 Da
  • Monoisotopic mass423.223022 Da
  • ChemSpider ID35033468

  • defined stereocentres - 6 of 6 defined stereocentres

More details:

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

(2s,5s)-2-Amino-6-[(2r,3s,4r,5r)-5-(6-Amino-9h-Purin-9-Yl)-3,4-Dihydroxytetrahydrofuran-2-Yl]-5-(Propylamino)hexanoic Acid
(5S)-6-[(2R,3S,4R,5R)-5-(6-Amino-9H-purin-9-yl)-3,4-dihydroxytetrahydro-2-furanyl]-5-(propylamino)-L-norleucin [German] [ACD/IUPAC Name]
(5S)-6-[(2R,3S,4R,5R)-5-(6-Amino-9H-purin-9-yl)-3,4-dihydroxytetrahydro-2-furanyl]-5-(propylamino)-L-norleucine [ACD/IUPAC Name]
(5S)-6-[(2R,3S,4R,5R)-5-(6-Amino-9H-purin-9-yl)-3,4-dihydroxytétrahydro-2-furanyl]-5-(propylamino)-L-norleucine [French] [ACD/IUPAC Name]
0UM

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

Density: 1.7±0.1 g/cm3
Boiling Point: 753.8±70.0 °C at 760 mmHg
Vapour Pressure: 0.0±2.7 mmHg at 25°C
Enthalpy of Vaporization: 115.3±3.0 kJ/mol
Flash Point: 409.7±35.7 °C
Index of Refraction: 1.738
Molar Refractivity: 102.5±0.5 cm3
#H bond acceptors: 12
#H bond donors: 8
#Freely Rotating Bonds: 10
#Rule of 5 Violations: 2
ACD/LogP: -0.03
ACD/LogD (pH 5.5): -4.07
ACD/BCF (pH 5.5): 1.00
ACD/KOC (pH 5.5): 1.00
ACD/LogD (pH 7.4): -4.01
ACD/BCF (pH 7.4): 1.00
ACD/KOC (pH 7.4): 1.00
Polar Surface Area: 195 Å2
Polarizability: 40.6±0.5 10-24cm3
Surface Tension: 74.1±7.0 dyne/cm
Molar Volume: 254.6±7.0 cm3

Click to predict properties on the Chemicalize site


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