ChemSpider 2D Image | N-(3,4-Dimethylphenyl)-2-(4-ethyl-5-{[2-(1-methyl-1H-indol-3-yl)-2-oxoethyl]sulfanyl}-4H-1,2,4-triazol-3-yl)acetamide | C25H27N5O2S

N-(3,4-Dimethylphenyl)-2-(4-ethyl-5-{[2-(1-methyl-1H-indol-3-yl)-2-oxoethyl]sulfanyl}-4H-1,2,4-triazol-3-yl)acetamide

  • Molecular FormulaC25H27N5O2S
  • Average mass461.579 Da
  • Monoisotopic mass461.188538 Da
  • ChemSpider ID21116708

More details:

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

4H-1,2,4-Triazole-3-acetamide, N-(3,4-dimethylphenyl)-4-ethyl-5-[[2-(1-methyl-1H-indol-3-yl)-2-oxoethyl]thio]- [ACD/Index Name]
N-(3,4-Dimethylphenyl)-2-(4-ethyl-5-{[2-(1-methyl-1H-indol-3-yl)-2-oxoethyl]sulfanyl}-4H-1,2,4-triazol-3-yl)acetamid [German] [ACD/IUPAC Name]
N-(3,4-Dimethylphenyl)-2-(4-ethyl-5-{[2-(1-methyl-1H-indol-3-yl)-2-oxoethyl]sulfanyl}-4H-1,2,4-triazol-3-yl)acetamide [ACD/IUPAC Name]
N-(3,4-Diméthylphényl)-2-(4-éthyl-5-{[2-(1-méthyl-1H-indol-3-yl)-2-oxoéthyl]sulfanyl}-4H-1,2,4-triazol-3-yl)acétamide [French] [ACD/IUPAC Name]

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: 1.659
Molar Refractivity: 133.4±0.5 cm3
#H bond acceptors: 7
#H bond donors: 1
#Freely Rotating Bonds: 8
#Rule of 5 Violations: 0
ACD/LogP: 4.51
ACD/LogD (pH 5.5): 4.74
ACD/BCF (pH 5.5): 2360.72
ACD/KOC (pH 5.5): 9036.71
ACD/LogD (pH 7.4): 4.74
ACD/BCF (pH 7.4): 2360.93
ACD/KOC (pH 7.4): 9037.51
Polar Surface Area: 107 Å2
Polarizability: 52.9±0.5 10-24cm3
Surface Tension: 49.2±7.0 dyne/cm
Molar Volume: 361.9±7.0 cm3

Click to predict properties on the Chemicalize site


Advertisement