Found 1 result

Search term: JWFGIRIYYSVMLD (Found by InChIKey (skeleton match))

ChemSpider 2D Image | 5-(Mesitylamino)-3-(4-phenyl-1-piperazinyl)-6H-anthra[1,9-cd][1,2]oxazol-6-one | C33H30N4O2


  • Molecular FormulaC33H30N4O2
  • Average mass514.617 Da
  • Monoisotopic mass514.236877 Da
  • ChemSpider ID20273231

More details:

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

5-(Mesitylamino)-3-(4-phenyl-1-piperazinyl)-6H-anthra[1,9-cd][1,2]oxazol-6-on [German] [ACD/IUPAC Name]
5-(Mesitylamino)-3-(4-phenyl-1-piperazinyl)-6H-anthra[1,9-cd][1,2]oxazol-6-one [ACD/IUPAC Name]
5-(Mésitylamino)-3-(4-phényl-1-pipérazinyl)-6H-anthra[1,9-cd][1,2]oxazol-6-one [French] [ACD/IUPAC Name]
6H-Anthra[1,9-cd]isoxazol-6-one, 3-(4-phenyl-1-piperazinyl)-5-[(2,4,6-trimethylphenyl)amino]- [ACD/Index 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: 749.7±60.0 °C at 760 mmHg
Vapour Pressure: 0.0±2.5 mmHg at 25°C
Enthalpy of Vaporization: 109.3±3.0 kJ/mol
Flash Point: 407.2±32.9 °C
Index of Refraction: 1.704
Molar Refractivity: 154.2±0.3 cm3
#H bond acceptors: 6
#H bond donors: 1
#Freely Rotating Bonds: 4
#Rule of 5 Violations: 2
ACD/LogP: 6.37
ACD/LogD (pH 5.5):
ACD/BCF (pH 5.5):
ACD/KOC (pH 5.5):
ACD/LogD (pH 7.4):
ACD/BCF (pH 7.4):
ACD/KOC (pH 7.4):
Polar Surface Area: 62 Å2
Polarizability: 61.1±0.5 10-24cm3
Surface Tension: 62.2±3.0 dyne/cm
Molar Volume: 397.3±3.0 cm3

Click to predict properties on the Chemicalize site