ChemSpider 2D Image | 9-Cyclopentyl-8-methyl-2-{[5-(1-piperazinyl)-2-pyridinyl]amino}-8,9-dihydro-7H-pyrido[3',2':4,5]pyrrolo[2,3-d]pyrimidin-7-one | C24H28N8O

9-Cyclopentyl-8-methyl-2-{[5-(1-piperazinyl)-2-pyridinyl]amino}-8,9-dihydro-7H-pyrido[3',2':4,5]pyrrolo[2,3-d]pyrimidin-7-one

  • Molecular FormulaC24H28N8O
  • Average mass444.532 Da
  • Monoisotopic mass444.238617 Da
  • ChemSpider ID58946155

More details:

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

7H-Pyrido[3',2':4,5]pyrrolo[2,3-d]pyrimidin-7-one, 9-cyclopentyl-8,9-dihydro-8-methyl-2-[[5-(1-piperazinyl)-2-pyridinyl]amino]- [ACD/Index Name]
9-Cyclopentyl-8-methyl-2-{[5-(1-piperazinyl)-2-pyridinyl]amino}-8,9-dihydro-7H-pyrido[3',2':4,5]pyrrolo[2,3-d]pyrimidin-7-on [German] [ACD/IUPAC Name]
9-Cyclopentyl-8-methyl-2-{[5-(1-piperazinyl)-2-pyridinyl]amino}-8,9-dihydro-7H-pyrido[3',2':4,5]pyrrolo[2,3-d]pyrimidin-7-one [ACD/IUPAC Name]
9-Cyclopentyl-8-méthyl-2-{[5-(1-pipérazinyl)-2-pyridinyl]amino}-8,9-dihydro-7H-pyrido[3',2':4,5]pyrrolo[2,3-d]pyrimidin-7-one [French] [ACD/IUPAC 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: 724.4±70.0 °C at 760 mmHg
Vapour Pressure: 0.0±2.3 mmHg at 25°C
Enthalpy of Vaporization: 105.8±3.0 kJ/mol
Flash Point: 391.9±35.7 °C
Index of Refraction: 1.779
Molar Refractivity: 125.7±0.5 cm3
#H bond acceptors: 9
#H bond donors: 2
#Freely Rotating Bonds: 4
#Rule of 5 Violations: 0
ACD/LogP: 0.74
ACD/LogD (pH 5.5): -2.19
ACD/BCF (pH 5.5): 1.00
ACD/KOC (pH 5.5): 1.00
ACD/LogD (pH 7.4): 0.25
ACD/BCF (pH 7.4): 1.00
ACD/KOC (pH 7.4): 10.42
Polar Surface Area: 91 Å2
Polarizability: 49.8±0.5 10-24cm3
Surface Tension: 65.1±7.0 dyne/cm
Molar Volume: 299.8±7.0 cm3

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