ChemSpider 2D Image | 3-[3-(4-Phenyl-1-piperazinyl)(1,1-~2~H_2_)propyl]-2,4(1H,3H)-quinazolinedione | C21H22D2N4O2

3-[3-(4-Phenyl-1-piperazinyl)(1,1-2H2)propyl]-2,4(1H,3H)-quinazolinedione

  • Molecular FormulaC21H22D2N4O2
  • Average mass366.453 Da
  • Monoisotopic mass366.202484 Da
  • ChemSpider ID8722266

  • Non-standard isotope - Non-standard isotope

More details:

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

2,4(1H,3H)-Quinazolinedione, 3-[3-(4-phenyl-1-piperazinyl)propyl-1,1-d2]- [ACD/Index Name]
3-[3-(4-Phenyl-1-piperazinyl)(1,1-2H2)propyl]-2,4(1H,3H)-chinazolindion [German] [ACD/IUPAC Name]
3-[3-(4-Phenyl-1-piperazinyl)(1,1-2H2)propyl]-2,4(1H,3H)-quinazolinedione [ACD/IUPAC Name]
3-[3-(4-Phényl-1-pipérazinyl)(1,1-2H2)propyl]-2,4(1H,3H)-quinazolinedione [French] [ACD/IUPAC Name]

Predicted data is generated using the ACD/Labs Percepta Platform - PhysChem Module, version: 14.00

Density: 1.2±0.1 g/cm3
Boiling Point:
Vapour Pressure:
Enthalpy of Vaporization:
Flash Point:
Index of Refraction: 1.605
Molar Refractivity: 103.0±0.3 cm3
#H bond acceptors: 6
#H bond donors: 1
#Freely Rotating Bonds: 5
#Rule of 5 Violations: 0
ACD/LogP: 2.97
ACD/LogD (pH 5.5): 1.27
ACD/BCF (pH 5.5): 2.18
ACD/KOC (pH 5.5): 20.82
ACD/LogD (pH 7.4): 2.71
ACD/BCF (pH 7.4): 60.93
ACD/KOC (pH 7.4): 581.22
Polar Surface Area: 56 Å2
Polarizability: 40.8±0.5 10-24cm3
Surface Tension: 49.8±3.0 dyne/cm
Molar Volume: 299.2±3.0 cm3

Click to predict properties on the Chemicalize site


Advertisement