ChemSpider 2D Image | 5-(4-Bromophenyl)-N-[3-(methylsulfanyl)-1-([1,2,4]triazolo[4,3-a]pyridin-3-yl)propyl]pentanamide | C21H25BrN4OS

5-(4-Bromophenyl)-N-[3-(methylsulfanyl)-1-([1,2,4]triazolo[4,3-a]pyridin-3-yl)propyl]pentanamide

  • Molecular FormulaC21H25BrN4OS
  • Average mass461.418 Da
  • Monoisotopic mass460.093231 Da
  • ChemSpider ID33588634

More details:

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

5-(4-Bromophenyl)-N-[3-(methylsulfanyl)-1-([1,2,4]triazolo[4,3-a]pyridin-3-yl)propyl]pentanamide [ACD/IUPAC Name]
5-(4-Bromophényl)-N-[3-(méthylsulfanyl)-1-([1,2,4]triazolo[4,3-a]pyridin-3-yl)propyl]pentanamide [French] [ACD/IUPAC Name]
5-(4-Bromphenyl)-N-[3-(methylsulfanyl)-1-([1,2,4]triazolo[4,3-a]pyridin-3-yl)propyl]pentanamid [German] [ACD/IUPAC Name]
Benzenepentanamide, 4-bromo-N-[3-(methylthio)-1-(1,2,4-triazolo[4,3-a]pyridin-3-yl)propyl]- [ACD/Index Name]

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: 1.645
Molar Refractivity: 120.8±0.5 cm3
#H bond acceptors: 5
#H bond donors: 1
#Freely Rotating Bonds: 10
#Rule of 5 Violations: 0
ACD/LogP: 4.88
ACD/LogD (pH 5.5): 4.16
ACD/BCF (pH 5.5): 861.31
ACD/KOC (pH 5.5): 4388.04
ACD/LogD (pH 7.4): 4.17
ACD/BCF (pH 7.4): 863.50
ACD/KOC (pH 7.4): 4399.19
Polar Surface Area: 85 Å2
Polarizability: 47.9±0.5 10-24cm3
Surface Tension: 49.8±7.0 dyne/cm
Molar Volume: 333.4±7.0 cm3

Click to predict properties on the Chemicalize site


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