ChemSpider 2D Image | 1-(2-{[(2R)-2-Hydroxy-3-(2-methylphenoxy)propyl]amino}ethyl)-5-methyl-2,4(1H,3H)-pyrimidinedione | C17H23N3O4

1-(2-{[(2R)-2-Hydroxy-3-(2-methylphenoxy)propyl]amino}ethyl)-5-methyl-2,4(1H,3H)-pyrimidinedione

  • Molecular FormulaC17H23N3O4
  • Average mass333.382 Da
  • Monoisotopic mass333.168854 Da
  • ChemSpider ID34985157

  • defined stereocentres - 1 of 1 defined stereocentres

More details:

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

1-(2-{[(2R)-2-Hydroxy-3-(2-methylphenoxy)propyl]amino}ethyl)-5-methyl-2,4(1H,3H)-pyrimidindion [German] [ACD/IUPAC Name]
1-(2-{[(2R)-2-Hydroxy-3-(2-methylphenoxy)propyl]amino}ethyl)-5-methyl-2,4(1H,3H)-pyrimidinedione [ACD/IUPAC Name]
1-(2-{[(2R)-2-Hydroxy-3-(2-méthylphénoxy)propyl]amino}éthyl)-5-méthyl-2,4(1H,3H)-pyrimidinedione [French] [ACD/IUPAC Name]
2,4(1H,3H)-Pyrimidinedione, 1-[2-[[(2R)-2-hydroxy-3-(2-methylphenoxy)propyl]amino]ethyl]-5-methyl- [ACD/Index Name]
67227-55-8 [RN]
Primidolol [BAN] [INN] [USAN] [Wiki]
UNII-56QH73D78K

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

Density: 1.2±0.1 g/cm3
Boiling Point:
Vapour Pressure:
Enthalpy of Vaporization:
Flash Point:
Index of Refraction: 1.560
Molar Refractivity: 89.3±0.3 cm3
#H bond acceptors: 7
#H bond donors: 3
#Freely Rotating Bonds: 8
#Rule of 5 Violations: 0
ACD/LogP: 0.93
ACD/LogD (pH 5.5): -1.87
ACD/BCF (pH 5.5): 1.00
ACD/KOC (pH 5.5): 1.00
ACD/LogD (pH 7.4): -0.32
ACD/BCF (pH 7.4): 1.00
ACD/KOC (pH 7.4): 4.18
Polar Surface Area: 91 Å2
Polarizability: 35.4±0.5 10-24cm3
Surface Tension: 47.5±3.0 dyne/cm
Molar Volume: 276.3±3.0 cm3

Click to predict properties on the Chemicalize site


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