ChemSpider 2D Image | 1-[4-(4-{[8-Methyl-9-(3-methyl-2-thienyl)-6,8-dihydro-5H-pyrazolo[3,4-h]quinazolin-2-yl]amino}-1H-pyrazol-1-yl)-1-piperidinyl]ethanone | C25H28N8OS

1-[4-(4-{[8-Methyl-9-(3-methyl-2-thienyl)-6,8-dihydro-5H-pyrazolo[3,4-h]quinazolin-2-yl]amino}-1H-pyrazol-1-yl)-1-piperidinyl]ethanone

  • Molecular FormulaC25H28N8OS
  • Average mass488.608 Da
  • Monoisotopic mass488.210663 Da
  • ChemSpider ID58951639

More details:

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

1-[4-(4-{[8-Methyl-9-(3-methyl-2-thienyl)-6,8-dihydro-5H-pyrazolo[3,4-h]chinazolin-2-yl]amino}-1H-pyrazol-1-yl)-1-piperidinyl]ethanon [German] [ACD/IUPAC Name]
1-[4-(4-{[8-Methyl-9-(3-methyl-2-thienyl)-6,8-dihydro-5H-pyrazolo[3,4-h]quinazolin-2-yl]amino}-1H-pyrazol-1-yl)-1-piperidinyl]ethanone [ACD/IUPAC Name]
1-[4-(4-{[8-Méthyl-9-(3-méthyl-2-thiényl)-6,8-dihydro-5H-pyrazolo[3,4-h]quinazolin-2-yl]amino}-1H-pyrazol-1-yl)-1-pipéridinyl]éthanone [French] [ACD/IUPAC Name]
Ethanone, 1-[4-[4-[[6,8-dihydro-8-methyl-9-(3-methyl-2-thienyl)-5H-pyrazolo[3,4-h]quinazolin-2-yl]amino]-1H-pyrazol-1-yl]-1-piperidinyl]- [ACD/Index 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: 769.9±70.0 °C at 760 mmHg
Vapour Pressure: 0.0±2.6 mmHg at 25°C
Enthalpy of Vaporization: 112.1±3.0 kJ/mol
Flash Point: 419.4±35.7 °C
Index of Refraction: 1.779
Molar Refractivity: 137.7±0.5 cm3
#H bond acceptors: 9
#H bond donors: 1
#Freely Rotating Bonds: 4
#Rule of 5 Violations: 0
ACD/LogP: 3.25
ACD/LogD (pH 5.5): 3.35
ACD/BCF (pH 5.5): 205.66
ACD/KOC (pH 5.5): 1574.59
ACD/LogD (pH 7.4): 3.35
ACD/BCF (pH 7.4): 205.98
ACD/KOC (pH 7.4): 1577.04
Polar Surface Area: 122 Å2
Polarizability: 54.6±0.5 10-24cm3
Surface Tension: 62.7±7.0 dyne/cm
Molar Volume: 328.6±7.0 cm3

Click to predict properties on the Chemicalize site


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