Found 597 results

Search term: MF = 'C_{26}H_{26}N_{6}O_{3}S'
ChemSpider 2D Image | 2-[(5-{[(2,6-Dimethylphenyl)amino]methyl}-4-phenyl-4H-1,2,4-triazol-3-yl)sulfanyl]-N-(2-methyl-5-nitrophenyl)acetamide | C26H26N6O3S

2-[(5-{[(2,6-Dimethylphenyl)amino]methyl}-4-phenyl-4H-1,2,4-triazol-3-yl)sulfanyl]-N-(2-methyl-5-nitrophenyl)acetamide

  • Molecular FormulaC26H26N6O3S
  • Average mass502.588 Da
  • Monoisotopic mass502.178711 Da
  • ChemSpider ID959915

More details:

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

2-[(5-{[(2,6-Dimethylphenyl)amino]methyl}-4-phenyl-4H-1,2,4-triazol-3-yl)sulfanyl]-N-(2-methyl-5-nitrophenyl)acetamid [German] [ACD/IUPAC Name]
2-[(5-{[(2,6-Dimethylphenyl)amino]methyl}-4-phenyl-4H-1,2,4-triazol-3-yl)sulfanyl]-N-(2-methyl-5-nitrophenyl)acetamide [ACD/IUPAC Name]
2-[(5-{[(2,6-Diméthylphényl)amino]méthyl}-4-phényl-4H-1,2,4-triazol-3-yl)sulfanyl]-N-(2-méthyl-5-nitrophényl)acétamide [French] [ACD/IUPAC Name]
Acetamide, 2-[[5-[[(2,6-dimethylphenyl)amino]methyl]-4-phenyl-4H-1,2,4-triazol-3-yl]thio]-N-(2-methyl-5-nitrophenyl)- [ACD/Index Name]

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

BAS 01918330 [DBID]
ZINC00869034 [DBID]

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: 1.669
Molar Refractivity: 142.1±0.5 cm3
#H bond acceptors: 9
#H bond donors: 2
#Freely Rotating Bonds: 9
#Rule of 5 Violations: 2
ACD/LogP: 6.72
ACD/LogD (pH 5.5): 5.49
ACD/BCF (pH 5.5): 8755.13
ACD/KOC (pH 5.5): 23086.78
ACD/LogD (pH 7.4): 5.49
ACD/BCF (pH 7.4): 8761.79
ACD/KOC (pH 7.4): 23104.32
Polar Surface Area: 143 Å2
Polarizability: 56.3±0.5 10-24cm3
Surface Tension: 53.6±7.0 dyne/cm
Molar Volume: 380.7±7.0 cm3

Click to predict properties on the Chemicalize site


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