ChemSpider 2D Image | 8-Chloro-N-{3-[4-(2,5-dimethylphenyl)-1-piperazinyl]propyl}-2-methyl-7-oxo-2,3-dihydro-7H-[1,4]oxazino[2,3,4-ij]quinoline-6-carboxamide | C28H33ClN4O3

8-Chloro-N-{3-[4-(2,5-dimethylphenyl)-1-piperazinyl]propyl}-2-methyl-7-oxo-2,3-dihydro-7H-[1,4]oxazino[2,3,4-ij]quinoline-6-carboxamide

  • Molecular FormulaC28H33ClN4O3
  • Average mass509.040 Da
  • Monoisotopic mass508.224121 Da
  • ChemSpider ID20359409

More details:

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

7H-1,4-Oxazino[2,3,4-ij]quinoline-6-carboxamide, 8-chloro-N-[3-[4-(2,5-dimethylphenyl)-1-piperazinyl]propyl]-2,3-dihydro-2-methyl-7-oxo- [ACD/Index Name]
8-Chlor-N-{3-[4-(2,5-dimethylphenyl)-1-piperazinyl]propyl}-2-methyl-7-oxo-2,3-dihydro-7H-[1,4]oxazino[2,3,4-ij]chinolin-6-carboxamid [German] [ACD/IUPAC Name]
8-Chloro-N-{3-[4-(2,5-diméthylphényl)-1-pipérazinyl]propyl}-2-méthyl-7-oxo-2,3-dihydro-7H-[1,4]oxazino[2,3,4-ij]quinoléine-6-carboxamide [French] [ACD/IUPAC Name]
8-Chloro-N-{3-[4-(2,5-dimethylphenyl)-1-piperazinyl]propyl}-2-methyl-7-oxo-2,3-dihydro-7H-[1,4]oxazino[2,3,4-ij]quinoline-6-carboxamide [ACD/IUPAC Name]

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

Density: 1.3±0.1 g/cm3
Boiling Point: 727.5±60.0 °C at 760 mmHg
Vapour Pressure: 0.0±2.4 mmHg at 25°C
Enthalpy of Vaporization: 106.2±3.0 kJ/mol
Flash Point: 393.8±32.9 °C
Index of Refraction: 1.658
Molar Refractivity: 141.2±0.4 cm3
#H bond acceptors: 7
#H bond donors: 1
#Freely Rotating Bonds: 6
#Rule of 5 Violations: 1
ACD/LogP: 3.67
ACD/LogD (pH 5.5): 2.10
ACD/BCF (pH 5.5): 8.56
ACD/KOC (pH 5.5): 49.79
ACD/LogD (pH 7.4): 3.63
ACD/BCF (pH 7.4): 290.42
ACD/KOC (pH 7.4): 1689.91
Polar Surface Area: 65 Å2
Polarizability: 56.0±0.5 10-24cm3
Surface Tension: 63.1±5.0 dyne/cm
Molar Volume: 383.1±5.0 cm3

Click to predict properties on the Chemicalize site


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