ChemSpider 2D Image | (5S)-7-(2-Fluoro-3-pyridinyl)-3-(2-fluoro-4-pyridinyl)spiro[chromeno[2,3-c]pyridine-5,4'-[1,3]oxazol]-2'-amine | C24H15F2N5O2

(5S)-7-(2-Fluoro-3-pyridinyl)-3-(2-fluoro-4-pyridinyl)spiro[chromeno[2,3-c]pyridine-5,4'-[1,3]oxazol]-2'-amine

  • Molecular FormulaC24H15F2N5O2
  • Average mass443.405 Da
  • Monoisotopic mass443.119385 Da
  • ChemSpider ID35035368
  • defined stereocentres - 1 of 1 defined stereocentres


More details:






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

(5S)-7-(2-Fluoro-3-pyridinyl)-3-(2-fluoro-4-pyridinyl)spiro[chromeno[2,3-c]pyridine-5,4'-[1,3]oxazol]-2'-amine [ACD/IUPAC Name]
(5s)-7-(2-Fluoropyridin-3-Yl)-3-(2-Fluoropyridin-4-Yl)spiro[chromeno[2,3-C]pyridine-5,4'-[1,3]oxazol]-2'-Amine
Spiro[5H--1benzopyrano[2,3-c]pyridine-5,4'(5'H)-oxazol]-2'-amine, 7-(2-fluoro-3-pyridinyl)-3-(2-fluoro-4-pyridinyl)-, (5S)- [ACD/Index Name]

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

Density: 1.5±0.1 g/cm3
Boiling Point: 676.4±65.0 °C at 760 mmHg
Vapour Pressure: 0.0±2.1 mmHg at 25°C
Enthalpy of Vaporization: 99.3±3.0 kJ/mol
Flash Point: 362.9±34.3 °C
Index of Refraction: 1.733
Molar Refractivity: 115.0±0.5 cm3
#H bond acceptors: 7
#H bond donors: 2
#Freely Rotating Bonds: 2
#Rule of 5 Violations: 0
ACD/LogP: 2.71
ACD/LogD (pH 5.5): 2.79
ACD/BCF (pH 5.5): 77.39
ACD/KOC (pH 5.5): 781.48
ACD/LogD (pH 7.4): 2.79
ACD/BCF (pH 7.4): 77.79
ACD/KOC (pH 7.4): 785.46
Polar Surface Area: 96 Å2
Polarizability: 45.6±0.5 10-24cm3
Surface Tension: 57.8±7.0 dyne/cm
Molar Volume: 287.2±7.0 cm3

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