ChemSpider 2D Image | N-[2-Chloro-5-(trifluoromethyl)phenyl]-2-{[3-(3-methylbutyl)-4-oxo-3,4-dihydro-2-quinazolinyl]sulfanyl}acetamide | C22H21ClF3N3O2S

N-[2-Chloro-5-(trifluoromethyl)phenyl]-2-{[3-(3-methylbutyl)-4-oxo-3,4-dihydro-2-quinazolinyl]sulfanyl}acetamide

  • Molecular FormulaC22H21ClF3N3O2S
  • Average mass483.934 Da
  • Monoisotopic mass483.099518 Da
  • ChemSpider ID26013067

More details:

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

Acetamide, N-[2-chloro-5-(trifluoromethyl)phenyl]-2-[[3,4-dihydro-3-(3-methylbutyl)-4-oxo-2-quinazolinyl]thio]- [ACD/Index Name]
N-[2-Chlor-5-(trifluormethyl)phenyl]-2-{[3-(3-methylbutyl)-4-oxo-3,4-dihydro-2-chinazolinyl]sulfanyl}acetamid [German] [ACD/IUPAC Name]
N-[2-Chloro-5-(trifluoromethyl)phenyl]-2-{[3-(3-methylbutyl)-4-oxo-3,4-dihydro-2-quinazolinyl]sulfanyl}acetamide [ACD/IUPAC Name]
N-[2-Chloro-5-(trifluorométhyl)phényl]-2-{[3-(3-méthylbutyl)-4-oxo-3,4-dihydro-2-quinazolinyl]sulfanyl}acétamide [French] [ACD/IUPAC Name]
N-(2-Chloro-5-trifluoromethyl-phenyl)-2-[3-(3-methyl-butyl)-4-oxo-3,4-dihydro-quinazolin-2-ylsulfanyl]-acetamide
N-[2-chloro-5-(trifluoromethyl)phenyl]-2-{[3-(3-methylbutyl)-4-oxo-3,4-dihydroquinazolin-2-yl]sulfanyl}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: 1.599
Molar Refractivity: 120.2±0.5 cm3
#H bond acceptors: 5
#H bond donors: 1
#Freely Rotating Bonds: 8
#Rule of 5 Violations: 1
ACD/LogP: 5.84
ACD/LogD (pH 5.5): 5.10
ACD/BCF (pH 5.5): 4413.15
ACD/KOC (pH 5.5): 14141.78
ACD/LogD (pH 7.4): 5.10
ACD/BCF (pH 7.4): 4412.90
ACD/KOC (pH 7.4): 14140.99
Polar Surface Area: 87 Å2
Polarizability: 47.7±0.5 10-24cm3
Surface Tension: 43.4±7.0 dyne/cm
Molar Volume: 351.8±7.0 cm3

Click to predict properties on the Chemicalize site


Advertisement