ChemSpider 2D Image | 5'-Deoxy-5'-[(4-{[6-(1H-pyrazol-1-yl)-4-pyrimidinyl]oxy}benzyl)amino]thymidine | C24H25N7O5

5'-Deoxy-5'-[(4-{[6-(1H-pyrazol-1-yl)-4-pyrimidinyl]oxy}benzyl)amino]thymidine

  • Molecular FormulaC24H25N7O5
  • Average mass491.499 Da
  • Monoisotopic mass491.191711 Da
  • ChemSpider ID28660999

  • defined stereocentres - 3 of 3 defined stereocentres

More details:

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

5'-Deoxy-5'-[(4-{[6-(1H-pyrazol-1-yl)-4-pyrimidinyl]oxy}benzyl)amino]thymidine [ACD/IUPAC Name]
5'-Desoxy-5'-[(4-{[6-(1H-pyrazol-1-yl)-4-pyrimidinyl]oxy}benzyl)amino]thymidin [German] [ACD/IUPAC Name]
5'-Désoxy-5'-[(4-{[6-(1H-pyrazol-1-yl)-4-pyrimidinyl]oxy}benzyl)amino]thymidine [French] [ACD/IUPAC Name]
Thymidine, 5'-deoxy-5'-[[[4-[[6-(1H-pyrazol-1-yl)-4-pyrimidinyl]oxy]phenyl]methyl]amino]- [ACD/Index Name]

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: 1.723
Molar Refractivity: 128.7±0.5 cm3
#H bond acceptors: 12
#H bond donors: 3
#Freely Rotating Bonds: 8
#Rule of 5 Violations: 1
ACD/LogP: 1.63
ACD/LogD (pH 5.5): -1.65
ACD/BCF (pH 5.5): 1.00
ACD/KOC (pH 5.5): 1.00
ACD/LogD (pH 7.4): 0.05
ACD/BCF (pH 7.4): 1.00
ACD/KOC (pH 7.4): 11.62
Polar Surface Area: 144 Å2
Polarizability: 51.0±0.5 10-24cm3
Surface Tension: 64.8±7.0 dyne/cm
Molar Volume: 324.9±7.0 cm3

Click to predict properties on the Chemicalize site


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