ChemSpider 2D Image | 2-({[(4-Chlorophenyl)sulfonyl](methyl)amino}methyl)-6-oxo-1,6-dihydro-4-pyrimidinecarboxylic acid | C13H12ClN3O5S

2-({[(4-Chlorophenyl)sulfonyl](methyl)amino}methyl)-6-oxo-1,6-dihydro-4-pyrimidinecarboxylic acid

  • Molecular FormulaC13H12ClN3O5S
  • Average mass357.770 Da
  • Monoisotopic mass357.018616 Da
  • ChemSpider ID27455389

More details:

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

2-({[(4-Chlorophenyl)sulfonyl](methyl)amino}methyl)-6-oxo-1,6-dihydro-4-pyrimidinecarboxylic acid [ACD/IUPAC Name]
2-({[(4-Chlorphenyl)sulfonyl](methyl)amino}methyl)-6-oxo-1,6-dihydro-4-pyrimidincarbonsäure [German] [ACD/IUPAC Name]
4-Pyrimidinecarboxylic acid, 2-[[[(4-chlorophenyl)sulfonyl]methylamino]methyl]-1,6-dihydro-6-oxo- [ACD/Index Name]
Acide 2-({[(4-chlorophényl)sulfonyl](méthyl)amino}méthyl)-6-oxo-1,6-dihydro-4-pyrimidinecarboxylique [French] [ACD/IUPAC Name]
2-[(N-METHYL4-CHLOROBENZENESULFONAMIDO)METHYL]-6-OXO-1H-PYRIMIDINE-4-CARBOXYLIC ACID
2-{[[(4-chlorophenyl)sulfonyl](methyl)amino]methyl}-6-oxo-1,6-dihydropyrimidine-4-carboxylic acid

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

Density: 1.6±0.1 g/cm3
Boiling Point:
Vapour Pressure:
Enthalpy of Vaporization:
Flash Point:
Index of Refraction: 1.668
Molar Refractivity: 84.1±0.5 cm3
#H bond acceptors: 8
#H bond donors: 2
#Freely Rotating Bonds: 5
#Rule of 5 Violations: 0
ACD/LogP: 1.69
ACD/LogD (pH 5.5): -1.92
ACD/BCF (pH 5.5): 1.00
ACD/KOC (pH 5.5): 1.00
ACD/LogD (pH 7.4): -3.04
ACD/BCF (pH 7.4): 1.00
ACD/KOC (pH 7.4): 1.00
Polar Surface Area: 125 Å2
Polarizability: 33.4±0.5 10-24cm3
Surface Tension: 64.6±7.0 dyne/cm
Molar Volume: 225.7±7.0 cm3

Click to predict properties on the Chemicalize site


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