ChemSpider 2D Image | (2-Amino-5-{5-[2-amino-3-(1H-indol-3-yl)propoxy]-3-pyridinyl}phenyl)(2-fluorophenyl)methanone | C29H25FN4O2

(2-Amino-5-{5-[2-amino-3-(1H-indol-3-yl)propoxy]-3-pyridinyl}phenyl)(2-fluorophenyl)methanone

  • Molecular FormulaC29H25FN4O2
  • Average mass480.533 Da
  • Monoisotopic mass480.196167 Da
  • ChemSpider ID24808991

More details:

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

(2-Amino-5-{5-[2-amino-3-(1H-indol-3-yl)propoxy]-3-pyridinyl}phenyl)(2-fluorophenyl)methanone [ACD/IUPAC Name]
(2-Amino-5-{5-[2-amino-3-(1H-indol-3-yl)propoxy]-3-pyridinyl}phényl)(2-fluorophényl)méthanone [French] [ACD/IUPAC Name]
(2-Amino-5-{5-[2-amino-3-(1H-indol-3-yl)propoxy]-3-pyridinyl}phenyl)(2-fluorphenyl)methanon [German] [ACD/IUPAC Name]
Methanone, [2-amino-5-[5-[2-amino-3-(1H-indol-3-yl)propoxy]-3-pyridinyl]phenyl](2-fluorophenyl)- [ACD/Index Name]
Kinome_855

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

Density: 1.3±0.1 g/cm3
Boiling Point: 773.6±60.0 °C at 760 mmHg
Vapour Pressure: 0.0±2.7 mmHg at 25°C
Enthalpy of Vaporization: 112.6±3.0 kJ/mol
Flash Point: 421.6±32.9 °C
Index of Refraction: 1.684
Molar Refractivity: 139.2±0.3 cm3
#H bond acceptors: 6
#H bond donors: 5
#Freely Rotating Bonds: 8
#Rule of 5 Violations: 1
ACD/LogP: 3.57
ACD/LogD (pH 5.5): 0.72
ACD/BCF (pH 5.5): 1.00
ACD/KOC (pH 5.5): 2.64
ACD/LogD (pH 7.4): 2.09
ACD/BCF (pH 7.4): 9.43
ACD/KOC (pH 7.4): 61.19
Polar Surface Area: 107 Å2
Polarizability: 55.2±0.5 10-24cm3
Surface Tension: 61.2±3.0 dyne/cm
Molar Volume: 366.8±3.0 cm3

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