ChemSpider 2D Image | 1-Methyl-5-(5-{[4-(~2~H_3_)methyl-1-piperazinyl]sulfonyl}-2-propoxyphenyl)-3-propyl-1,6-dihydro-7H-pyrazolo[4,3-d]pyrimidin-7-one | C23H29D3N6O4S

1-Methyl-5-(5-{[4-(2H3)methyl-1-piperazinyl]sulfonyl}-2-propoxyphenyl)-3-propyl-1,6-dihydro-7H-pyrazolo[4,3-d]pyrimidin-7-one

  • Molecular FormulaC23H29D3N6O4S
  • Average mass491.621 Da
  • Monoisotopic mass491.239410 Da
  • ChemSpider ID58778776

  • Non-standard isotope - Non-standard isotope

More details:

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

1-Methyl-5-(5-{[4-(2H3)methyl-1-piperazinyl]sulfonyl}-2-propoxyphenyl)-3-propyl-1,6-dihydro-7H-pyrazolo[4,3-d]pyrimidin-7-on [German] [ACD/IUPAC Name]
1-Methyl-5-(5-{[4-(2H3)methyl-1-piperazinyl]sulfonyl}-2-propoxyphenyl)-3-propyl-1,6-dihydro-7H-pyrazolo[4,3-d]pyrimidin-7-one [ACD/IUPAC Name]
1-Méthyl-5-(5-{[4-(2H3)méthyl-1-pipérazinyl]sulfonyl}-2-propoxyphényl)-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, 1,6-dihydro-1-methyl-5-[5-[[4-(methyl-d3)-1-piperazinyl]sulfonyl]-2-propoxyphenyl]-3-propyl- [ACD/Index Name]

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

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): 1.57
ACD/BCF (pH 5.5): 6.43
ACD/KOC (pH 5.5): 86.98
ACD/LogD (pH 7.4): 2.18
ACD/BCF (pH 7.4): 26.59
ACD/KOC (pH 7.4): 359.82
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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