ChemSpider 2D Image | 2-(2-Chloro-4-fluorobenzyl)-4-(4-methylbenzyl)-2,4-dihydro[1,2,4]triazolo[4,3-a]quinazoline-1,5-dione | C24H18ClFN4O2

2-(2-Chloro-4-fluorobenzyl)-4-(4-methylbenzyl)-2,4-dihydro[1,2,4]triazolo[4,3-a]quinazoline-1,5-dione

  • Molecular FormulaC24H18ClFN4O2
  • Average mass448.877 Da
  • Monoisotopic mass448.110229 Da
  • ChemSpider ID29026804

More details:

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

[1,2,4]Triazolo[4,3-a]quinazoline-1,5-dione, 2-[(2-chloro-4-fluorophenyl)methyl]-2,4-dihydro-4-[(4-methylphenyl)methyl]- [ACD/Index Name]
2-(2-Chlor-4-fluorbenzyl)-4-(4-methylbenzyl)-2,4-dihydro[1,2,4]triazolo[4,3-a]chinazolin-1,5-dion [German] [ACD/IUPAC Name]
2-(2-Chloro-4-fluorobenzyl)-4-(4-methylbenzyl)-2,4-dihydro[1,2,4]triazolo[4,3-a]quinazoline-1,5-dione [ACD/IUPAC Name]
2-(2-Chloro-4-fluorobenzyl)-4-(4-méthylbenzyl)-2,4-dihydro[1,2,4]triazolo[4,3-a]quinazoline-1,5-dione [French] [ACD/IUPAC Name]
1357712-79-8 [RN]
2-(2-chloro-4-fluorobenzyl)-4-(4-methylbenzyl)-[1,2,4]triazolo[4,3-a]quinazoline-1,5(2H,4H)-dione
2-[(2-chloro-4-fluorophenyl)methyl]-4-[(4-methylphenyl)methyl]-1H,2H,4H,5H-[1,2,4]triazolo[4,3-a]quinazoline-1,5-dione

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

Density: 1.4±0.1 g/cm3
Boiling Point: 594.0±60.0 °C at 760 mmHg
Vapour Pressure: 0.0±1.7 mmHg at 25°C
Enthalpy of Vaporization: 88.5±3.0 kJ/mol
Flash Point: 313.0±32.9 °C
Index of Refraction: 1.686
Molar Refractivity: 121.3±0.5 cm3
#H bond acceptors: 6
#H bond donors: 0
#Freely Rotating Bonds: 4
#Rule of 5 Violations: 0
ACD/LogP: 3.44
ACD/LogD (pH 5.5): 3.88
ACD/BCF (pH 5.5): 522.73
ACD/KOC (pH 5.5): 3071.47
ACD/LogD (pH 7.4): 3.88
ACD/BCF (pH 7.4): 522.73
ACD/KOC (pH 7.4): 3071.47
Polar Surface Area: 56 Å2
Polarizability: 48.1±0.5 10-24cm3
Surface Tension: 53.3±7.0 dyne/cm
Molar Volume: 319.0±7.0 cm3

Click to predict properties on the Chemicalize site


Advertisement