ChemSpider 2D Image | 2-{[3-(4-Chlorobenzyl)-4-oxo-3,4-dihydro-2-quinazolinyl]sulfanyl}-N-(2,5-difluorophenyl)acetamide | C23H16ClF2N3O2S

2-{[3-(4-Chlorobenzyl)-4-oxo-3,4-dihydro-2-quinazolinyl]sulfanyl}-N-(2,5-difluorophenyl)acetamide

  • Molecular FormulaC23H16ClF2N3O2S
  • Average mass471.907 Da
  • Monoisotopic mass471.061981 Da
  • ChemSpider ID26013259

More details:

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

2-{[3-(4-Chlorbenzyl)-4-oxo-3,4-dihydro-2-chinazolinyl]sulfanyl}-N-(2,5-difluorphenyl)acetamid [German] [ACD/IUPAC Name]
2-{[3-(4-Chlorobenzyl)-4-oxo-3,4-dihydro-2-quinazolinyl]sulfanyl}-N-(2,5-difluorophenyl)acetamide [ACD/IUPAC Name]
2-{[3-(4-Chlorobenzyl)-4-oxo-3,4-dihydro-2-quinazolinyl]sulfanyl}-N-(2,5-difluorophényl)acétamide [French] [ACD/IUPAC Name]
Acetamide, 2-[[3-[(4-chlorophenyl)methyl]-3,4-dihydro-4-oxo-2-quinazolinyl]thio]-N-(2,5-difluorophenyl)- [ACD/Index Name]
2-[3-(4-Chloro-benzyl)-4-oxo-3,4-dihydro-quinazolin-2-ylsulfanyl]-N-(2,5-difluoro-phenyl)-acetamide
2-{[3-(4-chlorobenzyl)-4-oxo-3,4-dihydroquinazolin-2-yl]sulfanyl}-N-(2,5-difluorophenyl)acetamide

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

Density: 1.4±0.1 g/cm3
Boiling Point:
Vapour Pressure:
Enthalpy of Vaporization:
Flash Point:
Index of Refraction: 1.656
Molar Refractivity: 122.3±0.5 cm3
#H bond acceptors: 5
#H bond donors: 1
#Freely Rotating Bonds: 6
#Rule of 5 Violations: 1
ACD/LogP: 5.30
ACD/LogD (pH 5.5): 4.76
ACD/BCF (pH 5.5): 2424.67
ACD/KOC (pH 5.5): 9211.48
ACD/LogD (pH 7.4): 4.76
ACD/BCF (pH 7.4): 2424.39
ACD/KOC (pH 7.4): 9210.43
Polar Surface Area: 87 Å2
Polarizability: 48.5±0.5 10-24cm3
Surface Tension: 50.4±7.0 dyne/cm
Molar Volume: 332.9±7.0 cm3

Click to predict properties on the Chemicalize site


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