ChemSpider 2D Image | N-{2-[(4-Chlorobenzyl)sulfanyl]ethyl}-6-methyl-2,4-dioxo-1,2,3,4-tetrahydro-5-pyrimidinesulfonamide | C14H16ClN3O4S2

N-{2-[(4-Chlorobenzyl)sulfanyl]ethyl}-6-methyl-2,4-dioxo-1,2,3,4-tetrahydro-5-pyrimidinesulfonamide

  • Molecular FormulaC14H16ClN3O4S2
  • Average mass389.878 Da
  • Monoisotopic mass389.027069 Da
  • ChemSpider ID27425907

More details:

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

5-Pyrimidinesulfonamide, N-[2-[[(4-chlorophenyl)methyl]thio]ethyl]-1,2,3,4-tetrahydro-6-methyl-2,4-dioxo- [ACD/Index Name]
N-{2-[(4-Chlorbenzyl)sulfanyl]ethyl}-6-methyl-2,4-dioxo-1,2,3,4-tetrahydro-5-pyrimidinsulfonamid [German] [ACD/IUPAC Name]
N-{2-[(4-Chlorobenzyl)sulfanyl]ethyl}-6-methyl-2,4-dioxo-1,2,3,4-tetrahydro-5-pyrimidinesulfonamide [ACD/IUPAC Name]
N-{2-[(4-Chlorobenzyl)sulfanyl]éthyl}-6-méthyl-2,4-dioxo-1,2,3,4-tétrahydro-5-pyrimidinesulfonamide [French] [ACD/IUPAC Name]
N-(2-{[(4-CHLOROPHENYL)METHYL]SULFANYL}ETHYL)-2-HYDROXY-4-METHYL-6-OXO-1H-PYRIMIDINE-5-SULFONAMIDE
N-{2-[(4-chlorobenzyl)sulfanyl]ethyl}-2-hydroxy-4-methyl-6-oxo-1,6-dihydropyrimidine-5-sulfonamide

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: 1.673
Molar Refractivity: 94.8±0.5 cm3
#H bond acceptors: 7
#H bond donors: 3
#Freely Rotating Bonds: 7
#Rule of 5 Violations: 0
ACD/LogP: 2.07
ACD/LogD (pH 5.5): 1.63
ACD/BCF (pH 5.5): 9.01
ACD/KOC (pH 5.5): 143.46
ACD/LogD (pH 7.4): 0.13
ACD/BCF (pH 7.4): 1.00
ACD/KOC (pH 7.4): 4.51
Polar Surface Area: 142 Å2
Polarizability: 37.6±0.5 10-24cm3
Surface Tension: 61.4±7.0 dyne/cm
Molar Volume: 252.9±7.0 cm3

Click to predict properties on the Chemicalize site


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