ChemSpider 2D Image | 5-[(3-Methoxyphenyl)amino]-3-[4-(2,3,4-trimethoxybenzyl)-1-piperazinyl]-6H-anthra[1,9-cd][1,2]oxazol-6-one | C35H34N4O6

5-[(3-Methoxyphenyl)amino]-3-[4-(2,3,4-trimethoxybenzyl)-1-piperazinyl]-6H-anthra[1,9-cd][1,2]oxazol-6-one

  • Molecular FormulaC35H34N4O6
  • Average mass606.668 Da
  • Monoisotopic mass606.247864 Da
  • ChemSpider ID22467847

More details:

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

5-[(3-Methoxyphenyl)amino]-3-[4-(2,3,4-trimethoxybenzyl)-1-piperazinyl]-6H-anthra[1,9-cd][1,2]oxazol-6-on [German] [ACD/IUPAC Name]
5-[(3-Methoxyphenyl)amino]-3-[4-(2,3,4-trimethoxybenzyl)-1-piperazinyl]-6H-anthra[1,9-cd][1,2]oxazol-6-one [ACD/IUPAC Name]
5-[(3-Méthoxyphényl)amino]-3-[4-(2,3,4-triméthoxybenzyl)-1-pipérazinyl]-6H-anthra[1,9-cd][1,2]oxazol-6-one [French] [ACD/IUPAC Name]
6H-Anthra[1,9-cd]isoxazol-6-one, 5-[(3-methoxyphenyl)amino]-3-[4-[(2,3,4-trimethoxyphenyl)methyl]-1-piperazinyl]- [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: 785.5±60.0 °C at 760 mmHg
Vapour Pressure: 0.0±2.7 mmHg at 25°C
Enthalpy of Vaporization: 114.3±3.0 kJ/mol
Flash Point: 428.9±32.9 °C
Index of Refraction: 1.669
Molar Refractivity: 171.2±0.3 cm3
#H bond acceptors: 10
#H bond donors: 1
#Freely Rotating Bonds: 9
#Rule of 5 Violations: 2
ACD/LogP: 4.54
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: 99 Å2
Polarizability: 67.9±0.5 10-24cm3
Surface Tension: 59.8±3.0 dyne/cm
Molar Volume: 458.6±3.0 cm3

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