ChemSpider 2D Image | N-(6-Amino-1-benzyl-2,4-dioxo-1,2,3,4-tetrahydro-5-pyrimidinyl)-4-fluoro-N-methylbenzenesulfonamide | C18H17FN4O4S

N-(6-Amino-1-benzyl-2,4-dioxo-1,2,3,4-tetrahydro-5-pyrimidinyl)-4-fluoro-N-methylbenzenesulfonamide

  • Molecular FormulaC18H17FN4O4S
  • Average mass404.415 Da
  • Monoisotopic mass404.095459 Da
  • ChemSpider ID34949654

More details:






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

Benzenesulfonamide, N-[6-amino-1,2,3,4-tetrahydro-2,4-dioxo-1-(phenylmethyl)-5-pyrimidinyl]-4-fluoro-N-methyl- [ACD/Index Name]
N-(6-Amino-1-benzyl-2,4-dioxo-1,2,3,4-tetrahydro-5-pyrimidinyl)-4-fluor-N-methylbenzolsulfonamid [German] [ACD/IUPAC Name]
N-(6-Amino-1-benzyl-2,4-dioxo-1,2,3,4-tetrahydro-5-pyrimidinyl)-4-fluoro-N-methylbenzenesulfonamide [ACD/IUPAC Name]
N-(6-Amino-1-benzyl-2,4-dioxo-1,2,3,4-tétrahydro-5-pyrimidinyl)-4-fluoro-N-méthylbenzènesulfonamide [French] [ACD/IUPAC Name]
N-(6-Amino-1-Benzyl-2,4-Dioxo-1,2,3,4-Tetrahydropyrimidin-5-Yl)-4-Fluoro-N-Methylbenzenesulfonamide
Analogue of 1a, 8k
JWT

Predicted data is generated using the ACD/Labs Percepta Platform - PhysChem Module

Density: 1.5±0.1 g/cm3
Boiling Point:
Vapour Pressure:
Enthalpy of Vaporization:
Flash Point:
Index of Refraction: 1.688
Molar Refractivity: 100.9±0.4 cm3
#H bond acceptors: 8
#H bond donors: 3
#Freely Rotating Bonds: 5
#Rule of 5 Violations: 0
ACD/LogP: 1.79
ACD/LogD (pH 5.5): 1.14
ACD/BCF (pH 5.5): 4.28
ACD/KOC (pH 5.5): 98.15
ACD/LogD (pH 7.4): 1.10
ACD/BCF (pH 7.4): 3.94
ACD/KOC (pH 7.4): 90.39
Polar Surface Area: 121 Å2
Polarizability: 40.0±0.5 10-24cm3
Surface Tension: 74.4±5.0 dyne/cm
Molar Volume: 264.4±5.0 cm3

Click to predict properties on the Chemicalize site






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