Found 20 results

Search term: MF = 'C_{20}H_{15}BrN_{6}O_{4}S'
ChemSpider 2D Image | 2-[(4-Allyl-5-oxo-4,5-dihydro[1,2,4]triazolo[4,3-a]quinazolin-1-yl)sulfanyl]-N-(2-bromo-4-nitrophenyl)acetamide | C20H15BrN6O4S

2-[(4-Allyl-5-oxo-4,5-dihydro[1,2,4]triazolo[4,3-a]quinazolin-1-yl)sulfanyl]-N-(2-bromo-4-nitrophenyl)acetamide

  • Molecular FormulaC20H15BrN6O4S
  • Average mass515.340 Da
  • Monoisotopic mass514.005859 Da
  • ChemSpider ID3708456

More details:

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

2-[(4-Allyl-5-oxo-4,5-dihydro[1,2,4]triazolo[4,3-a]chinazolin-1-yl)sulfanyl]-N-(2-brom-4-nitrophenyl)acetamid [German] [ACD/IUPAC Name]
2-[(4-Allyl-5-oxo-4,5-dihydro[1,2,4]triazolo[4,3-a]quinazolin-1-yl)sulfanyl]-N-(2-bromo-4-nitrophenyl)acetamide [ACD/IUPAC Name]
2-[(4-Allyl-5-oxo-4,5-dihydro[1,2,4]triazolo[4,3-a]quinazolin-1-yl)sulfanyl]-N-(2-bromo-4-nitrophényl)acétamide [French] [ACD/IUPAC Name]
Acetamide, N-(2-bromo-4-nitrophenyl)-2-[[4,5-dihydro-5-oxo-4-(2-propen-1-yl)[1,2,4]triazolo[4,3-a]quinazolin-1-yl]thio]- [ACD/Index Name]

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

Density: 1.7±0.1 g/cm3
Boiling Point:
Vapour Pressure:
Enthalpy of Vaporization:
Flash Point:
Index of Refraction: 1.759
Molar Refractivity: 124.1±0.5 cm3
#H bond acceptors: 10
#H bond donors: 1
#Freely Rotating Bonds: 7
#Rule of 5 Violations: 2
ACD/LogP: 4.82
ACD/LogD (pH 5.5): 3.67
ACD/BCF (pH 5.5): 362.69
ACD/KOC (pH 5.5): 2364.36
ACD/LogD (pH 7.4): 3.67
ACD/BCF (pH 7.4): 362.47
ACD/KOC (pH 7.4): 2362.93
Polar Surface Area: 151 Å2
Polarizability: 49.2±0.5 10-24cm3
Surface Tension: 71.2±7.0 dyne/cm
Molar Volume: 302.0±7.0 cm3

Click to predict properties on the Chemicalize site


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