ChemSpider 2D Image | 2-{[3-(Dimethylsulfamoyl)-4-methylphenyl]amino}-2-oxoethyl 3-(1H-tetrazol-1-yl)-2-thiophenecarboxylate | C17H18N6O5S2

2-{[3-(Dimethylsulfamoyl)-4-methylphenyl]amino}-2-oxoethyl 3-(1H-tetrazol-1-yl)-2-thiophenecarboxylate

  • Molecular FormulaC17H18N6O5S2
  • Average mass450.492 Da
  • Monoisotopic mass450.078003 Da
  • ChemSpider ID33604249

More details:

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

2-{[3-(Dimethylsulfamoyl)-4-methylphenyl]amino}-2-oxoethyl 3-(1H-tetrazol-1-yl)-2-thiophenecarboxylate [ACD/IUPAC Name]
2-{[3-(Dimethylsulfamoyl)-4-methylphenyl]amino}-2-oxoethyl-3-(1H-tetrazol-1-yl)-2-thiophencarboxylat [German] [ACD/IUPAC Name]
2-Thiophenecarboxylic acid, 3-(1H-tetrazol-1-yl)-, 2-[[3-[(dimethylamino)sulfonyl]-4-methylphenyl]amino]-2-oxoethyl ester [ACD/Index Name]
3-(1H-Tétrazol-1-yl)-2-thiophènecarboxylate de 2-{[3-(diméthylsulfamoyl)-4-méthylphényl]amino}-2-oxoéthyle [French] [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: 1.698
Molar Refractivity: 113.5±0.5 cm3
#H bond acceptors: 11
#H bond donors: 1
#Freely Rotating Bonds: 8
#Rule of 5 Violations: 1
ACD/LogP: 1.03
ACD/LogD (pH 5.5): 1.06
ACD/BCF (pH 5.5): 3.76
ACD/KOC (pH 5.5): 89.75
ACD/LogD (pH 7.4): 1.06
ACD/BCF (pH 7.4): 3.76
ACD/KOC (pH 7.4): 89.75
Polar Surface Area: 173 Å2
Polarizability: 45.0±0.5 10-24cm3
Surface Tension: 64.0±7.0 dyne/cm
Molar Volume: 294.2±7.0 cm3

Click to predict properties on the Chemicalize site


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