ChemSpider 2D Image | Remdesivir-d4 | C27H31D4N6O8P

Remdesivir-d4

  • Molecular FormulaC27H31D4N6O8P
  • Average mass606.601 Da
  • Monoisotopic mass606.250488 Da
  • ChemSpider ID90606574

  • defined stereocentres - 6 of 6 defined stereocentres

    Non-standard isotope - Non-standard isotope

More details:

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

(2S)-2-{[(S)-{[(2R,3S,4R,5R)-5-(4-Aminopyrrolo[2,1-f][1,2,4]triazin-7-yl)-5-cyano-3,4-dihydroxytétrahydro-2-furanyl]méthoxy}(phénoxy)phosphoryl]amino}(2H4)propanoate de 2-éthylbutyle (non-preferre d name) [French] [ACD/IUPAC Name]
2-Ethylbutyl (2S)-2-{[(S)-{[(2R,3S,4R,5R)-5-(4-aminopyrrolo[2,1-f][1,2,4]triazin-7-yl)-5-cyano-3,4-dihydroxytetrahydro-2-furanyl]methoxy}(phenoxy)phosphoryl]amino}(2H4)propanoate (non-preferred na ;me) [ACD/IUPAC Name]
2-Ethylbutyl-(2S)-2-{[(S)-{[(2R,3S,4R,5R)-5-(4-aminopyrrolo[2,1-f][1,2,4]triazin-7-yl)-5-cyan-3,4-dihydroxytetrahydro-2-furanyl]methoxy}(phenoxy)phosphoryl]amino}(2H4)propanoat (non-preferred name 
) [German] [ACD/IUPAC Name]
Remdesivir-d4

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

Density: 1.5±0.1 g/cm3
Boiling Point:
Vapour Pressure:
Enthalpy of Vaporization:
Flash Point:
Index of Refraction: 1.652
Molar Refractivity: 149.5±0.5 cm3
#H bond acceptors: 14
#H bond donors: 5
#Freely Rotating Bonds: 15
#Rule of 5 Violations: 3
ACD/LogP: 2.10
ACD/LogD (pH 5.5): 1.08
ACD/BCF (pH 5.5): 3.85
ACD/KOC (pH 5.5): 90.54
ACD/LogD (pH 7.4): 1.09
ACD/BCF (pH 7.4): 3.98
ACD/KOC (pH 7.4): 93.54
Polar Surface Area: 213 Å2
Polarizability: 59.3±0.5 10-24cm3
Surface Tension: 62.3±7.0 dyne/cm
Molar Volume: 409.0±7.0 cm3

Click to predict properties on the Chemicalize site


Advertisement