ChemSpider 2D Image | 4-{[(5-Nitro-6-oxo-1,6-dihydro-4-pyrimidinyl)amino]methyl}benzenesulfonamide | C11H11N5O5S

4-{[(5-Nitro-6-oxo-1,6-dihydro-4-pyrimidinyl)amino]methyl}benzenesulfonamide

  • Molecular FormulaC11H11N5O5S
  • Average mass325.301 Da
  • Monoisotopic mass325.048096 Da
  • ChemSpider ID25058732

More details:

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

4-{[(5-Nitro-6-oxo-1,6-dihydro-4-pyrimidinyl)amino]methyl}benzenesulfonamide [ACD/IUPAC Name]
4-{[(5-Nitro-6-oxo-1,6-dihydro-4-pyrimidinyl)amino]méthyl}benzènesulfonamide [French] [ACD/IUPAC Name]
4-{[(5-Nitro-6-oxo-1,6-dihydro-4-pyrimidinyl)amino]methyl}benzolsulfonamid [German] [ACD/IUPAC Name]
4-{[(5-nitro-6-oxo-1,6-dihydropyrimidin-4-yl)amino]methyl}benzenesulfonamide
Benzenesulfonamide, 4-[[(1,6-dihydro-5-nitro-6-oxo-4-pyrimidinyl)amino]methyl]- [ACD/Index Name]

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

Density: 1.7±0.1 g/cm3
Boiling Point:
Vapour Pressure:
Enthalpy of Vaporization:
Flash Point:
Index of Refraction: 1.743
Molar Refractivity: 75.5±0.5 cm3
#H bond acceptors: 10
#H bond donors: 4
#Freely Rotating Bonds: 5
#Rule of 5 Violations: 1
ACD/LogP: -2.78
ACD/LogD (pH 5.5): -1.96
ACD/BCF (pH 5.5): 1.00
ACD/KOC (pH 5.5): 2.00
ACD/LogD (pH 7.4): -2.64
ACD/BCF (pH 7.4): 1.00
ACD/KOC (pH 7.4): 1.00
Polar Surface Area: 168 Å2
Polarizability: 29.9±0.5 10-24cm3
Surface Tension: 86.0±7.0 dyne/cm
Molar Volume: 186.6±7.0 cm3

Click to predict properties on the Chemicalize site


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