ChemSpider 2D Image | 5-{7-[3-(Diethylamino)-1-propyn-1-yl]-1,4-dihydroindeno[1,2-c]pyrazol-3-yl}-2-pyridinecarbonitrile | C23H21N5

5-{7-[3-(Diethylamino)-1-propyn-1-yl]-1,4-dihydroindeno[1,2-c]pyrazol-3-yl}-2-pyridinecarbonitrile

  • Molecular FormulaC23H21N5
  • Average mass367.446 Da
  • Monoisotopic mass367.179688 Da
  • ChemSpider ID24808755

More details:

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

2-Pyridinecarbonitrile, 5-[7-[3-(diethylamino)-1-propyn-1-yl]-1,4-dihydroindeno[1,2-c]pyrazol-3-yl]- [ACD/Index Name]
5-{7-[3-(Diethylamino)-1-propin-1-yl]-1,4-dihydroindeno[1,2-c]pyrazol-3-yl}-2-pyridincarbonitril [German] [ACD/IUPAC Name]
5-{7-[3-(Diethylamino)-1-propyn-1-yl]-1,4-dihydroindeno[1,2-c]pyrazol-3-yl}-2-pyridinecarbonitrile [ACD/IUPAC Name]
5-{7-[3-(Diéthylamino)-1-propyn-1-yl]-1,4-dihydroindéno[1,2-c]pyrazol-3-yl}-2-pyridinecarbonitrile [French] [ACD/IUPAC Name]
Kinome_2096

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

Density: 1.3±0.1 g/cm3
Boiling Point: 631.9±55.0 °C at 760 mmHg
Vapour Pressure: 0.0±1.9 mmHg at 25°C
Enthalpy of Vaporization: 93.4±3.0 kJ/mol
Flash Point: 336.0±31.5 °C
Index of Refraction: 1.678
Molar Refractivity: 107.1±0.4 cm3
#H bond acceptors: 5
#H bond donors: 1
#Freely Rotating Bonds: 7
#Rule of 5 Violations: 0
ACD/LogP: 4.47
ACD/LogD (pH 5.5): 1.26
ACD/BCF (pH 5.5): 1.25
ACD/KOC (pH 5.5): 7.32
ACD/LogD (pH 7.4): 2.93
ACD/BCF (pH 7.4): 59.08
ACD/KOC (pH 7.4): 346.19
Polar Surface Area: 69 Å2
Polarizability: 42.5±0.5 10-24cm3
Surface Tension: 75.9±5.0 dyne/cm
Molar Volume: 284.2±5.0 cm3

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