ChemSpider 2D Image | N-({5-[(2-Amino-2-oxoethyl)sulfanyl]-4-methyl-4H-1,2,4-triazol-3-yl}methyl)-4-methoxybenzamide | C14H17N5O3S

N-({5-[(2-Amino-2-oxoethyl)sulfanyl]-4-methyl-4H-1,2,4-triazol-3-yl}methyl)-4-methoxybenzamide

  • Molecular FormulaC14H17N5O3S
  • Average mass335.382 Da
  • Monoisotopic mass335.105194 Da
  • ChemSpider ID21116850

More details:

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

Benzamide, N-[[5-[(2-amino-2-oxoethyl)thio]-4-methyl-4H-1,2,4-triazol-3-yl]methyl]-4-methoxy- [ACD/Index Name]
N-({5-[(2-Amino-2-oxoethyl)sulfanyl]-4-methyl-4H-1,2,4-triazol-3-yl}methyl)-4-methoxybenzamid [German] [ACD/IUPAC Name]
N-({5-[(2-Amino-2-oxoethyl)sulfanyl]-4-methyl-4H-1,2,4-triazol-3-yl}methyl)-4-methoxybenzamide [ACD/IUPAC Name]
N-({5-[(2-Amino-2-oxoéthyl)sulfanyl]-4-méthyl-4H-1,2,4-triazol-3-yl}méthyl)-4-méthoxybenzamide [French] [ACD/IUPAC Name]
N-({5-[(2-amino-2-oxoethyl)thio]-4-methyl-4H-1,2,4-triazol-3-yl}methyl)-4-methoxybenzamide
N-(5-Carbamoylmethylsulfanyl-4-methyl-4H-[1,2,4]triazol-3-ylmethyl)-4-methoxy-benzamide

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: 1.662
Molar Refractivity: 87.5±0.5 cm3
#H bond acceptors: 8
#H bond donors: 3
#Freely Rotating Bonds: 7
#Rule of 5 Violations: 0
ACD/LogP: 0.31
ACD/LogD (pH 5.5): 0.31
ACD/BCF (pH 5.5): 1.00
ACD/KOC (pH 5.5): 34.89
ACD/LogD (pH 7.4): 0.31
ACD/BCF (pH 7.4): 1.00
ACD/KOC (pH 7.4): 34.90
Polar Surface Area: 137 Å2
Polarizability: 34.7±0.5 10-24cm3
Surface Tension: 57.3±7.0 dyne/cm
Molar Volume: 236.5±7.0 cm3

Click to predict properties on the Chemicalize site


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