ChemSpider 2D Image | 7-[(1R)-1-(2,6-Dichloro-3-fluorophenyl)ethoxy]-3-[1-(4-piperidinyl)-1H-pyrazol-4-yl]furo[3,2-c]pyridin-6-amine | C23H22Cl2FN5O2

7-[(1R)-1-(2,6-Dichloro-3-fluorophenyl)ethoxy]-3-[1-(4-piperidinyl)-1H-pyrazol-4-yl]furo[3,2-c]pyridin-6-amine

  • Molecular FormulaC23H22Cl2FN5O2
  • Average mass490.358 Da
  • Monoisotopic mass489.113464 Da
  • ChemSpider ID30829835
  • defined stereocentres - 1 of 1 defined stereocentres


More details:






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

7-[(1R)-1-(2,6-Dichlor-3-fluorphenyl)ethoxy]-3-[1-(4-piperidinyl)-1H-pyrazol-4-yl]furo[3,2-c]pyridin-6-amin [German] [ACD/IUPAC Name]
7-[(1R)-1-(2,6-Dichloro-3-fluorophenyl)ethoxy]-3-[1-(4-piperidinyl)-1H-pyrazol-4-yl]furo[3,2-c]pyridin-6-amine [ACD/IUPAC Name]
7-[(1R)-1-(2,6-Dichloro-3-fluorophényl)éthoxy]-3-[1-(4-pipéridinyl)-1H-pyrazol-4-yl]furo[3,2-c]pyridin-6-amine [French] [ACD/IUPAC Name]
7-[(1r)-1-(2,6-Dichloro-3-Fluorophenyl)ethoxy]-3-[1-(Piperidin-4-Yl)-1h-Pyrazol-4-Yl]furo[3,2-C]pyridin-6-Amine
Furo[3,2-c]pyridin-6-amine, 7-[(1R)-1-(2,6-dichloro-3-fluorophenyl)ethoxy]-3-[1-(4-piperidinyl)-1H-pyrazol-4-yl]- [ACD/Index Name]
10.1016/j.bmcl.2013.05.074
1RU

Predicted data is generated using the ACD/Labs Percepta Platform - PhysChem Module

Density: 1.6±0.1 g/cm3
Boiling Point: 668.6±55.0 °C at 760 mmHg
Vapour Pressure: 0.0±2.0 mmHg at 25°C
Enthalpy of Vaporization: 98.3±3.0 kJ/mol
Flash Point: 358.1±31.5 °C
Index of Refraction: 1.705
Molar Refractivity: 122.5±0.5 cm3
#H bond acceptors: 7
#H bond donors: 3
#Freely Rotating Bonds: 5
#Rule of 5 Violations: 0
ACD/LogP: 4.98
ACD/LogD (pH 5.5): 0.93
ACD/BCF (pH 5.5): 1.00
ACD/KOC (pH 5.5): 1.89
ACD/LogD (pH 7.4): 2.09
ACD/BCF (pH 7.4): 6.21
ACD/KOC (pH 7.4): 27.55
Polar Surface Area: 91 Å2
Polarizability: 48.6±0.5 10-24cm3
Surface Tension: 54.8±7.0 dyne/cm
Molar Volume: 315.2±7.0 cm3

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