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Search term: ZJPHCFVVUDEEFO-HHUAMSDTSA-N (Found by InChIKey (full match))

ChemSpider 2D Image | (3R)-N-(Adamantan-1-yl)-3-ethyl-7-oxo-2,3-dihydro-7H-[1,4]oxazino[2,3,4-ij]quinoline-6-carboxamide | C24H28N2O3

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

  • Molecular FormulaC24H28N2O3
  • Average mass392.491 Da
  • Monoisotopic mass392.209991 Da
  • ChemSpider ID28641842
  • defined stereocentres - 1 of 5 defined stereocentres


More details:






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

(3R)-N-(Adamantan-1-yl)-3-ethyl-7-oxo-2,3-dihydro-7H-[1,4]oxazino[2,3,4-ij]chinolin-6-carboxamid [German] [ACD/IUPAC Name]
(3R)-N-(Adamantan-1-yl)-3-éthyl-7-oxo-2,3-dihydro-7H-[1,4]oxazino[2,3,4-ij]quinoléine-6-carboxamide [French] [ACD/IUPAC Name]
(3R)-N-(Adamantan-1-yl)-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, 3-ethyl-2,3-dihydro-7-oxo-N-tricyclo[3.3.1.13,7]dec-1-yl-, (3R)- [ACD/Index Name]

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

Density: 1.3±0.1 g/cm3
Boiling Point: 587.0±50.0 °C at 760 mmHg
Vapour Pressure: 0.0±1.6 mmHg at 25°C
Enthalpy of Vaporization: 87.7±3.0 kJ/mol
Flash Point: 308.8±30.1 °C
Index of Refraction: 1.649
Molar Refractivity: 109.0±0.4 cm3
#H bond acceptors: 5
#H bond donors: 1
#Freely Rotating Bonds: 3
#Rule of 5 Violations: 0
ACD/LogP: 3.06
ACD/LogD (pH 5.5): 3.12
ACD/BCF (pH 5.5): 137.84
ACD/KOC (pH 5.5): 1182.96
ACD/LogD (pH 7.4): 3.12
ACD/BCF (pH 7.4): 137.83
ACD/KOC (pH 7.4): 1182.91
Polar Surface Area: 59 Å2
Polarizability: 43.2±0.5 10-24cm3
Surface Tension: 59.7±5.0 dyne/cm
Molar Volume: 299.1±5.0 cm3

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