ChemSpider 2D Image | (5S)-7-(2-Fluoro-3-pyridinyl)-3-[(3-methyl-3-oxetanyl)ethynyl]spiro[chromeno[2,3-b]pyridine-5,4'-[1,3]oxazol]-2'-amine | C25H19FN4O3

(5S)-7-(2-Fluoro-3-pyridinyl)-3-[(3-methyl-3-oxetanyl)ethynyl]spiro[chromeno[2,3-b]pyridine-5,4'-[1,3]oxazol]-2'-amine

  • Molecular FormulaC25H19FN4O3
  • Average mass442.442 Da
  • Monoisotopic mass442.144104 Da
  • ChemSpider ID35035221

  • 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-[(3-methyl-3-oxetanyl)ethynyl]spiro[chromeno[2,3-b]pyridine-5,4'-[1,3]oxazol]-2'-amine [ACD/IUPAC Name]
(5s)-7-(2-Fluoropyridin-3-Yl)-3-[(3-Methyloxetan-3-Yl)ethynyl]spiro[chromeno[2,3-B]pyridine-5,4'-[1,3]oxazol]-2'-Amine
Spiro[5H--1benzopyrano[2,3-b]pyridine-5,4'(5'H)-oxazol]-2'-amine, 7-(2-fluoro-3-pyridinyl)-3-[2-(3-methyl-3-oxetanyl)ethynyl]-, (5S)- [ACD/Index Name]
(4S)-7'-(2-fluoropyridin-3-yl)-3'-[2-(3-methyloxetan-3-yl)ethynyl]spiro[5H-1,3-oxazole-4,5'-chromeno[2,3-b]pyridine]-2-amine
(S)-7-(2-Fluoropyridin-3-yl)-3-((3-methyloxetan-3-yl)ethynyl)-5'h-spiro[chromeno[2,3-b]pyridine-5,4'-oxazol]-2'-amine
1215868-94-2 [RN]
AMG-8718
https://www.ebi.ac.uk/chembl/compoundreportcard/CHEMBL3359763/
MFCD28902223

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

    Density: 1.4±0.1 g/cm3
    Boiling Point: 673.7±65.0 °C at 760 mmHg
    Vapour Pressure: 0.0±2.1 mmHg at 25°C
    Enthalpy of Vaporization: 98.9±3.0 kJ/mol
    Flash Point: 361.2±34.3 °C
    Index of Refraction: 1.699
    Molar Refractivity: 118.5±0.5 cm3
    #H bond acceptors: 7
    #H bond donors: 2
    #Freely Rotating Bonds: 3
    #Rule of 5 Violations: 0
    ACD/LogP: 2.47
    ACD/LogD (pH 5.5): 2.82
    ACD/BCF (pH 5.5): 81.12
    ACD/KOC (pH 5.5): 804.27
    ACD/LogD (pH 7.4): 2.83
    ACD/BCF (pH 7.4): 82.94
    ACD/KOC (pH 7.4): 822.29
    Polar Surface Area: 92 Å2
    Polarizability: 47.0±0.5 10-24cm3
    Surface Tension: 55.5±7.0 dyne/cm
    Molar Volume: 306.7±7.0 cm3

    Click to predict properties on the Chemicalize site


    Advertisement