ChemSpider 2D Image | 3,5-Dinitro-N-(4-{[(2,4,4-trimethyl-2-pentanyl)carbamoyl]sulfamoyl}benzyl)benzamide | C23H29N5O8S

3,5-Dinitro-N-(4-{[(2,4,4-trimethyl-2-pentanyl)carbamoyl]sulfamoyl}benzyl)benzamide

  • Molecular FormulaC23H29N5O8S
  • Average mass535.570 Da
  • Monoisotopic mass535.173706 Da
  • ChemSpider ID66488253

More details:

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

3,5-Dinitro-N-(4-{[(2,4,4-trimethyl-2-pentanyl)carbamoyl]sulfamoyl}benzyl)benzamid [German] [ACD/IUPAC Name]
3,5-Dinitro-N-(4-{[(2,4,4-trimethyl-2-pentanyl)carbamoyl]sulfamoyl}benzyl)benzamide [ACD/IUPAC Name]
3,5-Dinitro-N-(4-{[(2,4,4-triméthyl-2-pentanyl)carbamoyl]sulfamoyl}benzyl)benzamide [French] [ACD/IUPAC Name]
Benzamide, 3,5-dinitro-N-[[4-[[[[(1,1,3,3-tetramethylbutyl)amino]carbonyl]amino]sulfonyl]phenyl]methyl]- [ACD/Index Name]

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: 1.582
Molar Refractivity: 134.5±0.4 cm3
#H bond acceptors: 13
#H bond donors: 3
#Freely Rotating Bonds: 10
#Rule of 5 Violations: 2
ACD/LogP: 3.76
ACD/LogD (pH 5.5): 2.56
ACD/BCF (pH 5.5): 31.40
ACD/KOC (pH 5.5): 226.91
ACD/LogD (pH 7.4): 1.53
ACD/BCF (pH 7.4): 2.93
ACD/KOC (pH 7.4): 21.21
Polar Surface Area: 204 Å2
Polarizability: 53.3±0.5 10-24cm3
Surface Tension: 55.2±3.0 dyne/cm
Molar Volume: 402.8±3.0 cm3

Click to predict properties on the Chemicalize site


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