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Search term: JDKSZSKJOBLXNT-OAHLLOKOSA-N (Found by InChIKey (full match))

ChemSpider 2D Image | (3R)-N-Cycloheptyl-3-ethyl-7-oxo-2,3-dihydro-7H-[1,4]oxazino[2,3,4-ij]quinoline-6-carboxamide | C21H26N2O3

(3R)-N-Cycloheptyl-3-ethyl-7-oxo-2,3-dihydro-7H-[1,4]oxazino[2,3,4-ij]quinoline-6-carboxamide

  • Molecular FormulaC21H26N2O3
  • Average mass354.443 Da
  • Monoisotopic mass354.194336 Da
  • ChemSpider ID28640141
  • defined stereocentres - 1 of 1 defined stereocentres


More details:






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

(3R)-N-Cycloheptyl-3-ethyl-7-oxo-2,3-dihydro-7H-[1,4]oxazino[2,3,4-ij]chinolin-6-carboxamid [German] [ACD/IUPAC Name]
(3R)-N-Cycloheptyl-3-éthyl-7-oxo-2,3-dihydro-7H-[1,4]oxazino[2,3,4-ij]quinoléine-6-carboxamide [French] [ACD/IUPAC Name]
(3R)-N-Cycloheptyl-3-ethyl-7-oxo-2,3-dihydro-7H-[1,4]oxazino[2,3,4-ij]quinoline-6-carboxamide [ACD/IUPAC Name]
7H-1,4-Oxazino[2,3,4-ij]quinoline-6-carboxamide, N-cycloheptyl-3-ethyl-2,3-dihydro-7-oxo-, (3R)- [ACD/Index Name]

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

Density: 1.2±0.1 g/cm3
Boiling Point: 554.3±50.0 °C at 760 mmHg
Vapour Pressure: 0.0±1.5 mmHg at 25°C
Enthalpy of Vaporization: 83.5±3.0 kJ/mol
Flash Point: 289.0±30.1 °C
Index of Refraction: 1.609
Molar Refractivity: 99.2±0.4 cm3
#H bond acceptors: 5
#H bond donors: 1
#Freely Rotating Bonds: 3
#Rule of 5 Violations: 0
ACD/LogP: 2.80
ACD/LogD (pH 5.5): 2.87
ACD/BCF (pH 5.5): 88.64
ACD/KOC (pH 5.5): 862.44
ACD/LogD (pH 7.4): 2.87
ACD/BCF (pH 7.4): 88.64
ACD/KOC (pH 7.4): 862.41
Polar Surface Area: 59 Å2
Polarizability: 39.3±0.5 10-24cm3
Surface Tension: 54.2±5.0 dyne/cm
Molar Volume: 286.6±5.0 cm3

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