ChemSpider 2D Image | 5-{7-[4-(4-Morpholinyl)butoxy]-1,4-dihydroindeno[1,2-c]pyrazol-3-yl}-2-pyridinecarbonitrile | C24H25N5O2

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

  • Molecular FormulaC24H25N5O2
  • Average mass415.488 Da
  • Monoisotopic mass415.200836 Da
  • ChemSpider ID23306932

More details:

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

2-Pyridinecarbonitrile, 5-[1,4-dihydro-7-[4-(4-morpholinyl)butoxy]indeno[1,2-c]pyrazol-3-yl]- [ACD/Index Name]
5-{7-[4-(4-Morpholinyl)butoxy]-1,4-dihydroindeno[1,2-c]pyrazol-3-yl}-2-pyridincarbonitril [German] [ACD/IUPAC Name]
5-{7-[4-(4-Morpholinyl)butoxy]-1,4-dihydroindeno[1,2-c]pyrazol-3-yl}-2-pyridinecarbonitrile [ACD/IUPAC Name]
5-{7-[4-(4-Morpholinyl)butoxy]-1,4-dihydroindéno[1,2-c]pyrazol-3-yl}-2-pyridinecarbonitrile [French] [ACD/IUPAC Name]
5-{7-[4-(morpholin-4-yl)butoxy]-1,4-dihydroindeno[1,2-c]pyrazol-3-yl}pyridine-2-carbonitrile
5-(7-(4-morpholinobutoxy)-1,4-dihydroindeno[1,2-c]pyrazol-3-yl)picolinonitrile
CHEMBL398951
https://www.ebi.ac.uk/chembl/compoundreportcard/CHEMBL398951/
Kinome_2112

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

Density: 1.3±0.1 g/cm3
Boiling Point: 712.7±60.0 °C at 760 mmHg
Vapour Pressure: 0.0±2.3 mmHg at 25°C
Enthalpy of Vaporization: 104.2±3.0 kJ/mol
Flash Point: 384.8±32.9 °C
Index of Refraction: 1.665
Molar Refractivity: 115.2±0.4 cm3
#H bond acceptors: 7
#H bond donors: 1
#Freely Rotating Bonds: 8
#Rule of 5 Violations: 0
ACD/LogP: 2.61
ACD/LogD (pH 5.5): 0.96
ACD/BCF (pH 5.5): 1.09
ACD/KOC (pH 5.5): 10.61
ACD/LogD (pH 7.4): 2.55
ACD/BCF (pH 7.4): 42.75
ACD/KOC (pH 7.4): 415.45
Polar Surface Area: 87 Å2
Polarizability: 45.7±0.5 10-24cm3
Surface Tension: 74.9±5.0 dyne/cm
Molar Volume: 310.3±5.0 cm3

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