ChemSpider 2D Image | Methyl 5-(6-{[(4-hydroxycyclohexyl)amino]methyl}-1,4-dihydroindeno[1,2-c]pyrazol-3-yl)-2-furoate | C23H25N3O4

Methyl 5-(6-{[(4-hydroxycyclohexyl)amino]methyl}-1,4-dihydroindeno[1,2-c]pyrazol-3-yl)-2-furoate

  • Molecular FormulaC23H25N3O4
  • Average mass407.462 Da
  • Monoisotopic mass407.184509 Da
  • ChemSpider ID34948995

More details:

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

2-Furancarboxylic acid, 5-[1,4-dihydro-6-[[(4-hydroxycyclohexyl)amino]methyl]indeno[1,2-c]pyrazol-3-yl]-, methyl ester [ACD/Index Name]
5-(6-{[(4-Hydroxycyclohexyl)amino]méthyl}-1,4-dihydroindéno[1,2-c]pyrazol-3-yl)-2-furoate de méthyle [French] [ACD/IUPAC Name]
Methyl 5-(6-{[(4-hydroxycyclohexyl)amino]methyl}-1,4-dihydroindeno[1,2-c]pyrazol-3-yl)-2-furoate [ACD/IUPAC Name]
Methyl-5-(6-{[(4-hydroxycyclohexyl)amino]methyl}-1,4-dihydroindeno[1,2-c]pyrazol-3-yl)-2-furoat [German] [ACD/IUPAC Name]
Chk1_62

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

Density: 1.4±0.1 g/cm3
Boiling Point: 685.1±55.0 °C at 760 mmHg
Vapour Pressure: 0.0±2.2 mmHg at 25°C
Enthalpy of Vaporization: 105.5±3.0 kJ/mol
Flash Point: 368.1±31.5 °C
Index of Refraction: 1.660
Molar Refractivity: 109.6±0.4 cm3
#H bond acceptors: 7
#H bond donors: 3
#Freely Rotating Bonds: 6
#Rule of 5 Violations: 0
ACD/LogP: 2.63
ACD/LogD (pH 5.5): 0.03
ACD/BCF (pH 5.5): 1.00
ACD/KOC (pH 5.5): 1.00
ACD/LogD (pH 7.4): 0.84
ACD/BCF (pH 7.4): 1.00
ACD/KOC (pH 7.4): 6.39
Polar Surface Area: 100 Å2
Polarizability: 43.4±0.5 10-24cm3
Surface Tension: 71.4±5.0 dyne/cm
Molar Volume: 296.9±5.0 cm3

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