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

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

  • Molecular FormulaC23H16ClF2N3O2S
  • Average mass471.907 Da
  • Monoisotopic mass471.061981 Da
  • ChemSpider ID26013198

More details:

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

2-{[3-(3-Chlorbenzyl)-4-oxo-3,4-dihydro-2-chinazolinyl]sulfanyl}-N-(3,5-difluorphenyl)acetamid [German] [ACD/IUPAC Name]
2-{[3-(3-Chlorobenzyl)-4-oxo-3,4-dihydro-2-quinazolinyl]sulfanyl}-N-(3,5-difluorophenyl)acetamide [ACD/IUPAC Name]
2-{[3-(3-Chlorobenzyl)-4-oxo-3,4-dihydro-2-quinazolinyl]sulfanyl}-N-(3,5-difluorophényl)acétamide [French] [ACD/IUPAC Name]
Acetamide, 2-[[3-[(3-chlorophenyl)methyl]-3,4-dihydro-4-oxo-2-quinazolinyl]thio]-N-(3,5-difluorophenyl)- [ACD/Index Name]
2-[3-(3-Chloro-benzyl)-4-oxo-3,4-dihydro-quinazolin-2-ylsulfanyl]-N-(3,5-difluoro-phenyl)-acetamide
2-{[3-(3-chlorobenzyl)-4-oxo-3,4-dihydroquinazolin-2-yl]sulfanyl}-N-(3,5-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: 5.99
ACD/LogD (pH 5.5): 5.11
ACD/BCF (pH 5.5): 4509.67
ACD/KOC (pH 5.5): 14362.50
ACD/LogD (pH 7.4): 5.11
ACD/BCF (pH 7.4): 4509.41
ACD/KOC (pH 7.4): 14361.68
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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