ChemSpider 2D Image | 5-(2-Ethoxy-5-{[4-(~2~H_5_)ethyl-1-piperazinyl]sulfonyl}phenyl)-1-methyl-3-propyl-1,6-dihydro-7H-pyrazolo[4,3-d]pyrimidin-7-one | C23H27D5N6O4S

5-(2-Ethoxy-5-{[4-(2H5)ethyl-1-piperazinyl]sulfonyl}phenyl)-1-methyl-3-propyl-1,6-dihydro-7H-pyrazolo[4,3-d]pyrimidin-7-one

  • Molecular FormulaC23H27D5N6O4S
  • Average mass493.634 Da
  • Monoisotopic mass493.251953 Da
  • ChemSpider ID48062715
  • Non-standard isotope - Non-standard isotope


More details:






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

5-(2-Ethoxy-5-{[4-(2H5)ethyl-1-piperazinyl]sulfonyl}phenyl)-1-methyl-3-propyl-1,6-dihydro-7H-pyrazolo[4,3-d]pyrimidin-7-on [German] [ACD/IUPAC Name]
5-(2-Ethoxy-5-{[4-(2H5)ethyl-1-piperazinyl]sulfonyl}phenyl)-1-methyl-3-propyl-1,6-dihydro-7H-pyrazolo[4,3-d]pyrimidin-7-one [ACD/IUPAC Name]
5-(2-Éthoxy-5-{[4-(2H5)éthyl-1-pipérazinyl]sulfonyl}phényl)-1-méthyl-3-propyl-1,6-dihydro-7H-pyrazolo[4,3-d]pyrimidin-7-one [French] [ACD/IUPAC Name]
7H-Pyrazolo[4,3-d]pyrimidin-7-one, 5-[2-ethoxy-5-[[4-(ethyl-d5)-1-piperazinyl]sulfonyl]phenyl]-1,6-dihydro-1-methyl-3-propyl- [ACD/Index Name]
1216711-61-3 [RN]
5-[2-ethoxy-5-[4-(1,1,2,2,2-pentadeuterioethyl)piperazin-1-yl]sulfonylphenyl]-1-methyl-3-propyl-4H-pyrazolo[4,3-d]pyrimidin-7-one

Predicted data is generated using the ACD/Labs Percepta Platform - PhysChem Module

Density: 1.4±0.1 g/cm3
Boiling Point:
Vapour Pressure:
Enthalpy of Vaporization:
Flash Point:
Index of Refraction: 1.656
Molar Refractivity: 130.6±0.5 cm3
#H bond acceptors: 10
#H bond donors: 1
#Freely Rotating Bonds: 8
#Rule of 5 Violations: 1
ACD/LogP: 2.80
ACD/LogD (pH 5.5): 0.55
ACD/BCF (pH 5.5): 1.00
ACD/KOC (pH 5.5): 8.41
ACD/LogD (pH 7.4): 2.01
ACD/BCF (pH 7.4): 17.65
ACD/KOC (pH 7.4): 238.85
Polar Surface Area: 118 Å2
Polarizability: 51.8±0.5 10-24cm3
Surface Tension: 53.4±7.0 dyne/cm
Molar Volume: 355.5±7.0 cm3

Click to predict properties on the Chemicalize site






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