ChemSpider 2D Image | 4-Methoxy-N-{2-methyl-1-[4-methyl-5-({2-[(2-methyl-4-nitrophenyl)amino]-2-oxoethyl}sulfanyl)-4H-1,2,4-triazol-3-yl]propyl}benzamide | C24H28N6O5S

4-Methoxy-N-{2-methyl-1-[4-methyl-5-({2-[(2-methyl-4-nitrophenyl)amino]-2-oxoethyl}sulfanyl)-4H-1,2,4-triazol-3-yl]propyl}benzamide

  • Molecular FormulaC24H28N6O5S
  • Average mass512.581 Da
  • Monoisotopic mass512.184204 Da
  • ChemSpider ID4364261

More details:

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

4-Methoxy-N-{2-methyl-1-[4-methyl-5-({2-[(2-methyl-4-nitrophenyl)amino]-2-oxoethyl}sulfanyl)-4H-1,2,4-triazol-3-yl]propyl}benzamid [German] [ACD/IUPAC Name]
4-Methoxy-N-{2-methyl-1-[4-methyl-5-({2-[(2-methyl-4-nitrophenyl)amino]-2-oxoethyl}sulfanyl)-4H-1,2,4-triazol-3-yl]propyl}benzamide [ACD/IUPAC Name]
4-Méthoxy-N-{2-méthyl-1-[4-méthyl-5-({2-[(2-méthyl-4-nitrophényl)amino]-2-oxoéthyl}sulfanyl)-4H-1,2,4-triazol-3-yl]propyl}benzamide [French] [ACD/IUPAC Name]
Benzamide, 4-methoxy-N-[2-methyl-1-[4-methyl-5-[[2-[(2-methyl-4-nitrophenyl)amino]-2-oxoethyl]thio]-4H-1,2,4-triazol-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: 1.644
Molar Refractivity: 137.3±0.5 cm3
#H bond acceptors: 11
#H bond donors: 2
#Freely Rotating Bonds: 10
#Rule of 5 Violations: 2
ACD/LogP: 4.89
ACD/LogD (pH 5.5): 3.83
ACD/BCF (pH 5.5): 480.01
ACD/KOC (pH 5.5): 2889.56
ACD/LogD (pH 7.4): 3.83
ACD/BCF (pH 7.4): 480.01
ACD/KOC (pH 7.4): 2889.58
Polar Surface Area: 169 Å2
Polarizability: 54.4±0.5 10-24cm3
Surface Tension: 51.9±7.0 dyne/cm
Molar Volume: 379.1±7.0 cm3

Click to predict properties on the Chemicalize site


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