ChemSpider 2D Image | 3-{3-[4-(Diphenylmethyl)-1-piperazinyl]-3-oxopropyl}-7-methoxy-4,8-dimethyl-2H-chromen-2-one | C32H34N2O4

3-{3-[4-(Diphenylmethyl)-1-piperazinyl]-3-oxopropyl}-7-methoxy-4,8-dimethyl-2H-chromen-2-one

  • Molecular FormulaC32H34N2O4
  • Average mass510.623 Da
  • Monoisotopic mass510.251862 Da
  • ChemSpider ID17482267

More details:






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

2H-1-Benzopyran-2-one, 3-[3-[4-(diphenylmethyl)-1-piperazinyl]-3-oxopropyl]-7-methoxy-4,8-dimethyl- [ACD/Index Name]
3-{3-[4-(Diphenylmethyl)-1-piperazinyl]-3-oxopropyl}-7-methoxy-4,8-dimethyl-2H-chromen-2-on [German] [ACD/IUPAC Name]
3-{3-[4-(Diphenylmethyl)-1-piperazinyl]-3-oxopropyl}-7-methoxy-4,8-dimethyl-2H-chromen-2-one [ACD/IUPAC Name]
3-{3-[4-(Diphénylméthyl)-1-pipérazinyl]-3-oxopropyl}-7-méthoxy-4,8-diméthyl-2H-chromén-2-one [French] [ACD/IUPAC Name]
3-[3-(4-benzhydrylpiperazin-1-yl)-3-oxopropyl]-7-methoxy-4,8-dimethylchromen-2-one
3-{3-[4-(diphenylmethyl)piperazin-1-yl]-3-oxopropyl}-7-methoxy-4,8-dimethyl-2H-chromen-2-one
921042-76-4 [RN]
c32h34n2o4

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

Density: 1.2±0.1 g/cm3
Boiling Point: 676.7±55.0 °C at 760 mmHg
Vapour Pressure: 0.0±2.1 mmHg at 25°C
Enthalpy of Vaporization: 99.3±3.0 kJ/mol
Flash Point: 363.1±31.5 °C
Index of Refraction: 1.603
Molar Refractivity: 147.0±0.3 cm3
#H bond acceptors: 6
#H bond donors: 0
#Freely Rotating Bonds: 7
#Rule of 5 Violations: 2
ACD/LogP: 5.86
ACD/LogD (pH 5.5): 5.05
ACD/BCF (pH 5.5): 3650.49
ACD/KOC (pH 5.5): 10904.43
ACD/LogD (pH 7.4): 5.24
ACD/BCF (pH 7.4): 5611.63
ACD/KOC (pH 7.4): 16762.58
Polar Surface Area: 59 Å2
Polarizability: 58.3±0.5 10-24cm3
Surface Tension: 48.6±3.0 dyne/cm
Molar Volume: 427.9±3.0 cm3

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