ChemSpider 2D Image | 6-(2,5-Dichlorophenyl)-N-(4-{[2-(diethylamino)ethyl]carbamoyl}phenyl)-6,7-dihydro-4H-pyrazolo[5,1-c][1,4]oxazine-2-carboxamide | C26H29Cl2N5O3

6-(2,5-Dichlorophenyl)-N-(4-{[2-(diethylamino)ethyl]carbamoyl}phenyl)-6,7-dihydro-4H-pyrazolo[5,1-c][1,4]oxazine-2-carboxamide

  • Molecular FormulaC26H29Cl2N5O3
  • Average mass530.446 Da
  • Monoisotopic mass529.164734 Da
  • ChemSpider ID75897921

More details:






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

4H-Pyrazolo[5,1-c][1,4]oxazine-2-carboxamide, 6-(2,5-dichlorophenyl)-N-[4-[[[2-(diethylamino)ethyl]amino]carbonyl]phenyl]-6,7-dihydro- [ACD/Index Name]
6-(2,5-Dichlorophenyl)-N-(4-{[2-(diethylamino)ethyl]carbamoyl}phenyl)-6,7-dihydro-4H-pyrazolo[5,1-c][1,4]oxazine-2-carboxamide [ACD/IUPAC Name]
6-(2,5-Dichlorophényl)-N-(4-{[2-(diéthylamino)éthyl]carbamoyl}phényl)-6,7-dihydro-4H-pyrazolo[5,1-c][1,4]oxazine-2-carboxamide [French] [ACD/IUPAC Name]
6-(2,5-Dichlorphenyl)-N-(4-{[2-(diethylamino)ethyl]carbamoyl}phenyl)-6,7-dihydro-4H-pyrazolo[5,1-c][1,4]oxazin-2-carboxamid [German] [ACD/IUPAC Name]

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

Density: 1.4±0.1 g/cm3
Boiling Point: 661.8±55.0 °C at 760 mmHg
Vapour Pressure: 0.0±2.0 mmHg at 25°C
Enthalpy of Vaporization: 97.4±3.0 kJ/mol
Flash Point: 354.1±31.5 °C
Index of Refraction: 1.643
Molar Refractivity: 141.2±0.5 cm3
#H bond acceptors: 8
#H bond donors: 2
#Freely Rotating Bonds: 9
#Rule of 5 Violations: 1
ACD/LogP: 3.27
ACD/LogD (pH 5.5): 0.74
ACD/BCF (pH 5.5): 1.00
ACD/KOC (pH 5.5): 2.55
ACD/LogD (pH 7.4): 1.91
ACD/BCF (pH 7.4): 6.04
ACD/KOC (pH 7.4): 37.76
Polar Surface Area: 88 Å2
Polarizability: 56.0±0.5 10-24cm3
Surface Tension: 50.4±7.0 dyne/cm
Molar Volume: 390.2±7.0 cm3

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