ChemSpider 2D Image | 2-[(8-Chloro-5-oxo-4-propyl-4,5-dihydro[1,2,4]triazolo[4,3-a]quinazolin-1-yl)sulfanyl]-N-(3-chlorophenyl)acetamide | C20H17Cl2N5O2S

2-[(8-Chloro-5-oxo-4-propyl-4,5-dihydro[1,2,4]triazolo[4,3-a]quinazolin-1-yl)sulfanyl]-N-(3-chlorophenyl)acetamide

  • Molecular FormulaC20H17Cl2N5O2S
  • Average mass462.352 Da
  • Monoisotopic mass461.048004 Da
  • ChemSpider ID29026972

More details:

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

2-[(8-Chlor-5-oxo-4-propyl-4,5-dihydro[1,2,4]triazolo[4,3-a]chinazolin-1-yl)sulfanyl]-N-(3-chlorphenyl)acetamid [German] [ACD/IUPAC Name]
2-[(8-Chloro-5-oxo-4-propyl-4,5-dihydro[1,2,4]triazolo[4,3-a]quinazolin-1-yl)sulfanyl]-N-(3-chlorophenyl)acetamide [ACD/IUPAC Name]
2-[(8-Chloro-5-oxo-4-propyl-4,5-dihydro[1,2,4]triazolo[4,3-a]quinazolin-1-yl)sulfanyl]-N-(3-chlorophényl)acétamide [French] [ACD/IUPAC Name]
Acetamide, 2-[(8-chloro-4,5-dihydro-5-oxo-4-propyl[1,2,4]triazolo[4,3-a]quinazolin-1-yl)thio]-N-(3-chlorophenyl)- [ACD/Index Name]

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

Density: 1.5±0.1 g/cm3
Boiling Point:
Vapour Pressure:
Enthalpy of Vaporization:
Flash Point:
Index of Refraction: 1.724
Molar Refractivity: 120.1±0.5 cm3
#H bond acceptors: 7
#H bond donors: 1
#Freely Rotating Bonds: 6
#Rule of 5 Violations: 1
ACD/LogP: 5.74
ACD/LogD (pH 5.5): 4.55
ACD/BCF (pH 5.5): 1699.79
ACD/KOC (pH 5.5): 7143.54
ACD/LogD (pH 7.4): 4.55
ACD/BCF (pH 7.4): 1699.77
ACD/KOC (pH 7.4): 7143.46
Polar Surface Area: 105 Å2
Polarizability: 47.6±0.5 10-24cm3
Surface Tension: 60.9±7.0 dyne/cm
Molar Volume: 302.8±7.0 cm3

Click to predict properties on the Chemicalize site


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