ChemSpider 2D Image | Methyl 1-(2-{[4-methyl-3-(4-morpholinylsulfonyl)phenyl]amino}-2-oxoethyl)-1H-1,2,3-triazole-4-carboxylate | C17H21N5O6S

Methyl 1-(2-{[4-methyl-3-(4-morpholinylsulfonyl)phenyl]amino}-2-oxoethyl)-1H-1,2,3-triazole-4-carboxylate

  • Molecular FormulaC17H21N5O6S
  • Average mass423.444 Da
  • Monoisotopic mass423.121246 Da
  • ChemSpider ID30086271

More details:

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

1-(2-{[4-Méthyl-3-(4-morpholinylsulfonyl)phényl]amino}-2-oxoéthyl)-1H-1,2,3-triazole-4-carboxylate de méthyle [French] [ACD/IUPAC Name]
1H-1,2,3-Triazole-4-carboxylic acid, 1-[2-[[4-methyl-3-(4-morpholinylsulfonyl)phenyl]amino]-2-oxoethyl]-, methyl ester [ACD/Index Name]
Methyl 1-(2-{[4-methyl-3-(4-morpholinylsulfonyl)phenyl]amino}-2-oxoethyl)-1H-1,2,3-triazole-4-carboxylate [ACD/IUPAC Name]
Methyl-1-(2-{[4-methyl-3-(4-morpholinylsulfonyl)phenyl]amino}-2-oxoethyl)-1H-1,2,3-triazol-4-carboxylat [German] [ACD/IUPAC Name]

Predicted data is generated using the ACD/Labs Percepta Platform - PhysChem Module, version: 14.00

Density: 1.5±0.1 g/cm3
Boiling Point:
Vapour Pressure:
Enthalpy of Vaporization:
Flash Point:
Index of Refraction: 1.659
Molar Refractivity: 104.2±0.5 cm3
#H bond acceptors: 11
#H bond donors: 1
#Freely Rotating Bonds: 7
#Rule of 5 Violations: 1
ACD/LogP: -0.34
ACD/LogD (pH 5.5): 0.32
ACD/BCF (pH 5.5): 1.03
ACD/KOC (pH 5.5): 35.67
ACD/LogD (pH 7.4): 0.32
ACD/BCF (pH 7.4): 1.03
ACD/KOC (pH 7.4): 35.67
Polar Surface Area: 141 Å2
Polarizability: 41.3±0.5 10-24cm3
Surface Tension: 61.1±7.0 dyne/cm
Molar Volume: 282.4±7.0 cm3

Click to predict properties on the Chemicalize site


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