ChemSpider 2D Image | 6-(5-Chloro-2-methoxyphenyl)-N-{2-[4-(3-chlorophenyl)-1-piperazinyl]ethyl}-6,7-dihydro-4H-pyrazolo[5,1-c][1,4]oxazine-2-carboxamide | C26H29Cl2N5O3

6-(5-Chloro-2-methoxyphenyl)-N-{2-[4-(3-chlorophenyl)-1-piperazinyl]ethyl}-6,7-dihydro-4H-pyrazolo[5,1-c][1,4]oxazine-2-carboxamide

  • Molecular FormulaC26H29Cl2N5O3
  • Average mass530.446 Da
  • Monoisotopic mass529.164734 Da
  • ChemSpider ID75902760

More details:






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

4H-Pyrazolo[5,1-c][1,4]oxazine-2-carboxamide, 6-(5-chloro-2-methoxyphenyl)-N-[2-[4-(3-chlorophenyl)-1-piperazinyl]ethyl]-6,7-dihydro- [ACD/Index Name]
6-(5-Chlor-2-methoxyphenyl)-N-{2-[4-(3-chlorphenyl)-1-piperazinyl]ethyl}-6,7-dihydro-4H-pyrazolo[5,1-c][1,4]oxazin-2-carboxamid [German] [ACD/IUPAC Name]
6-(5-Chloro-2-methoxyphenyl)-N-{2-[4-(3-chlorophenyl)-1-piperazinyl]ethyl}-6,7-dihydro-4H-pyrazolo[5,1-c][1,4]oxazine-2-carboxamide [ACD/IUPAC Name]
6-(5-Chloro-2-méthoxyphényl)-N-{2-[4-(3-chlorophényl)-1-pipérazinyl]éthyl}-6,7-dihydro-4H-pyrazolo[5,1-c][1,4]oxazine-2-carboxamide [French] [ACD/IUPAC Name]

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

Density: 1.4±0.1 g/cm3
Boiling Point: 742.0±60.0 °C at 760 mmHg
Vapour Pressure: 0.0±2.5 mmHg at 25°C
Enthalpy of Vaporization: 108.2±3.0 kJ/mol
Flash Point: 402.6±32.9 °C
Index of Refraction: 1.665
Molar Refractivity: 140.3±0.5 cm3
#H bond acceptors: 8
#H bond donors: 1
#Freely Rotating Bonds: 7
#Rule of 5 Violations: 1
ACD/LogP: 3.09
ACD/LogD (pH 5.5): 3.14
ACD/BCF (pH 5.5): 82.88
ACD/KOC (pH 5.5): 429.18
ACD/LogD (pH 7.4): 4.09
ACD/BCF (pH 7.4): 733.12
ACD/KOC (pH 7.4): 3796.48
Polar Surface Area: 72 Å2
Polarizability: 55.6±0.5 10-24cm3
Surface Tension: 53.2±7.0 dyne/cm
Molar Volume: 377.8±7.0 cm3

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