ChemSpider 2D Image | N-(2,4-Dimethylphenyl)-2-({2-[2-(3,5-dimethyl-1H-pyrazol-1-yl)ethyl]-8,9-dimethoxy[1,2,4]triazolo[1,5-c]quinazolin-5-yl}sulfanyl)acetamide | C28H31N7O3S

N-(2,4-Dimethylphenyl)-2-({2-[2-(3,5-dimethyl-1H-pyrazol-1-yl)ethyl]-8,9-dimethoxy[1,2,4]triazolo[1,5-c]quinazolin-5-yl}sulfanyl)acetamide

  • Molecular FormulaC28H31N7O3S
  • Average mass545.656 Da
  • Monoisotopic mass545.220886 Da
  • ChemSpider ID20257326

More details:

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

Acetamide, N-(2,4-dimethylphenyl)-2-[[2-[2-(3,5-dimethyl-1H-pyrazol-1-yl)ethyl]-8,9-dimethoxy[1,2,4]triazolo[1,5-c]quinazolin-5-yl]thio]- [ACD/Index Name]
N-(2,4-Dimethylphenyl)-2-({2-[2-(3,5-dimethyl-1H-pyrazol-1-yl)ethyl]-8,9-dimethoxy[1,2,4]triazolo[1,5-c]chinazolin-5-yl}sulfanyl)acetamid [German] [ACD/IUPAC Name]
N-(2,4-Dimethylphenyl)-2-({2-[2-(3,5-dimethyl-1H-pyrazol-1-yl)ethyl]-8,9-dimethoxy[1,2,4]triazolo[1,5-c]quinazolin-5-yl}sulfanyl)acetamide [ACD/IUPAC Name]
N-(2,4-Diméthylphényl)-2-({2-[2-(3,5-diméthyl-1H-pyrazol-1-yl)éthyl]-8,9-diméthoxy[1,2,4]triazolo[1,5-c]quinazolin-5-yl}sulfanyl)acétamide [French] [ACD/IUPAC Name]
1015861-04-7 [RN]
2-((2-(2-(3,5-dimethyl-1H-pyrazol-1-yl)ethyl)-8,9-dimethoxy-[1,2,4]triazolo[1,5-c]quinazolin-5-yl)thio)-N-(2,4-dimethylphenyl)acetamide
2-({2-[2-(3,5-dimethyl-1H-pyrazol-1-yl)ethyl]-8,9-dimethoxy-[1,2,4]triazolo[1,5-c]quinazolin-5-yl}sulfanyl)-N-(2,4-dimethylphenyl)acetamide
N-(2,4-dimethylphenyl)-2-[[2-[2-(3,5-dimethylpyrazol-1-yl)ethyl]-8,9-dimethoxy-[1,2,4]triazolo[1,5-c]quinazolin-5-yl]sulfanyl]acetamide

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

Density: 1.3±0.1 g/cm3
Boiling Point:
Vapour Pressure:
Enthalpy of Vaporization:
Flash Point:
Index of Refraction: 1.677
Molar Refractivity: 152.4±0.5 cm3
#H bond acceptors: 10
#H bond donors: 1
#Freely Rotating Bonds: 9
#Rule of 5 Violations: 3
ACD/LogP: 5.17
ACD/LogD (pH 5.5): 4.21
ACD/BCF (pH 5.5): 933.91
ACD/KOC (pH 5.5): 4648.54
ACD/LogD (pH 7.4): 4.21
ACD/BCF (pH 7.4): 937.10
ACD/KOC (pH 7.4): 4664.42
Polar Surface Area: 134 Å2
Polarizability: 60.4±0.5 10-24cm3
Surface Tension: 50.1±7.0 dyne/cm
Molar Volume: 404.7±7.0 cm3

Click to predict properties on the Chemicalize site


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