ChemSpider 2D Image | 1-Isopropyl-N-{3-[4-(2-pyrimidinyl)-1-piperazinyl]propyl}-6-(2-thienyl)-1H-pyrazolo[3,4-b]pyridine-4-carboxamide | C25H30N8OS

1-Isopropyl-N-{3-[4-(2-pyrimidinyl)-1-piperazinyl]propyl}-6-(2-thienyl)-1H-pyrazolo[3,4-b]pyridine-4-carboxamide

  • Molecular FormulaC25H30N8OS
  • Average mass490.624 Da
  • Monoisotopic mass490.226318 Da
  • ChemSpider ID33637288

More details:

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

1H-Pyrazolo[3,4-b]pyridine-4-carboxamide, 1-(1-methylethyl)-N-[3-[4-(2-pyrimidinyl)-1-piperazinyl]propyl]-6-(2-thienyl)- [ACD/Index Name]
1-Isopropyl-N-{3-[4-(2-pyrimidinyl)-1-piperazinyl]propyl}-6-(2-thienyl)-1H-pyrazolo[3,4-b]pyridin-4-carboxamid [German] [ACD/IUPAC Name]
1-Isopropyl-N-{3-[4-(2-pyrimidinyl)-1-piperazinyl]propyl}-6-(2-thienyl)-1H-pyrazolo[3,4-b]pyridine-4-carboxamide [ACD/IUPAC Name]
1-Isopropyl-N-{3-[4-(2-pyrimidinyl)-1-pipérazinyl]propyl}-6-(2-thiényl)-1H-pyrazolo[3,4-b]pyridine-4-carboxamide [French] [ACD/IUPAC 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: 1.714
Molar Refractivity: 140.5±0.5 cm3
#H bond acceptors: 9
#H bond donors: 1
#Freely Rotating Bonds: 8
#Rule of 5 Violations: 0
ACD/LogP: 3.21
ACD/LogD (pH 5.5): 0.99
ACD/BCF (pH 5.5): 1.32
ACD/KOC (pH 5.5): 14.14
ACD/LogD (pH 7.4): 2.47
ACD/BCF (pH 7.4): 39.86
ACD/KOC (pH 7.4): 427.42
Polar Surface Area: 120 Å2
Polarizability: 55.7±0.5 10-24cm3
Surface Tension: 57.8±7.0 dyne/cm
Molar Volume: 358.0±7.0 cm3

Click to predict properties on the Chemicalize site


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