ChemSpider 2D Image | 2-{[5-Cyano-4-(3,4-dichlorophenyl)-6-oxo-1,6-dihydro-2-pyrimidinyl]sulfanyl}-N-(4-sulfamoylphenyl)propanamide | C20H15Cl2N5O4S2

2-{[5-Cyano-4-(3,4-dichlorophenyl)-6-oxo-1,6-dihydro-2-pyrimidinyl]sulfanyl}-N-(4-sulfamoylphenyl)propanamide

  • Molecular FormulaC20H15Cl2N5O4S2
  • Average mass524.400 Da
  • Monoisotopic mass522.994263 Da
  • ChemSpider ID30811229

More details:

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

2-{[5-Cyan-4-(3,4-dichlorphenyl)-6-oxo-1,6-dihydro-2-pyrimidinyl]sulfanyl}-N-(4-sulfamoylphenyl)propanamid [German] [ACD/IUPAC Name]
2-{[5-Cyano-4-(3,4-dichlorophenyl)-6-oxo-1,6-dihydro-2-pyrimidinyl]sulfanyl}-N-(4-sulfamoylphenyl)propanamide [ACD/IUPAC Name]
2-{[5-Cyano-4-(3,4-dichlorophényl)-6-oxo-1,6-dihydro-2-pyrimidinyl]sulfanyl}-N-(4-sulfamoylphényl)propanamide [French] [ACD/IUPAC Name]
Propanamide, N-[4-(aminosulfonyl)phenyl]-2-[[5-cyano-4-(3,4-dichlorophenyl)-1,6-dihydro-6-oxo-2-pyrimidinyl]thio]- [ACD/Index Name]

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: 1.724
Molar Refractivity: 128.3±0.5 cm3
#H bond acceptors: 9
#H bond donors: 4
#Freely Rotating Bonds: 7
#Rule of 5 Violations: 1
ACD/LogP: 2.87
ACD/LogD (pH 5.5): 0.97
ACD/BCF (pH 5.5): 1.31
ACD/KOC (pH 5.5): 14.59
ACD/LogD (pH 7.4): 0.60
ACD/BCF (pH 7.4): 1.00
ACD/KOC (pH 7.4): 6.23
Polar Surface Area: 188 Å2
Polarizability: 50.9±0.5 10-24cm3
Surface Tension: 67.7±7.0 dyne/cm
Molar Volume: 323.5±7.0 cm3

Click to predict properties on the Chemicalize site


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