ChemSpider 2D Image | 5-(2-Chlorophenyl)-3-methyl-8-(4-morpholinyl)-2,10-dihydropyrazolo[4,3-b]pyrido[4,3-e][1,4]diazepine | C20H19ClN6O

5-(2-Chlorophenyl)-3-methyl-8-(4-morpholinyl)-2,10-dihydropyrazolo[4,3-b]pyrido[4,3-e][1,4]diazepine

  • Molecular FormulaC20H19ClN6O
  • Average mass394.858 Da
  • Monoisotopic mass394.130890 Da
  • ChemSpider ID115008005

More details:

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

5-(2-Chlorophenyl)-3-methyl-8-(4-morpholinyl)-2,10-dihydropyrazolo[4,3-b]pyrido[4,3-e][1,4]diazepine [ACD/IUPAC Name]
5-(2-Chlorophényl)-3-méthyl-8-(4-morpholinyl)-2,10-dihydropyrazolo[4,3-b]pyrido[4,3-e][1,4]diazépine [French] [ACD/IUPAC Name]
5-(2-Chlorphenyl)-3-methyl-8-(4-morpholinyl)-2,10-dihydropyrazolo[4,3-b]pyrido[4,3-e][1,4]diazepin [German] [ACD/IUPAC Name]
Pyrazolo[4,3-b]pyrido[4,3-e][1,4]diazepine, 5-(2-chlorophenyl)-2,10-dihydro-3-methyl-8-(4-morpholinyl)- [ACD/Index Name]

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

Density: 1.5±0.1 g/cm3
Boiling Point: 665.9±55.0 °C at 760 mmHg
Vapour Pressure: 0.0±2.0 mmHg at 25°C
Enthalpy of Vaporization: 97.9±3.0 kJ/mol
Flash Point: 356.5±31.5 °C
Index of Refraction: 1.756
Molar Refractivity: 107.0±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): 3.19
ACD/BCF (pH 5.5): 138.23
ACD/KOC (pH 5.5): 1026.01
ACD/LogD (pH 7.4): 3.41
ACD/BCF (pH 7.4): 227.82
ACD/KOC (pH 7.4): 1691.02
Polar Surface Area: 78 Å2
Polarizability: 42.4±0.5 10-24cm3
Surface Tension: 59.8±7.0 dyne/cm
Molar Volume: 261.1±7.0 cm3

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