ChemSpider 2D Image | 1-Methyl-N-(2-{[4-(methylsulfonyl)-2-nitrophenyl]amino}ethyl)-6-oxo-1,4,5,6-tetrahydro-3-pyridazinecarboxamide | C15H19N5O6S

1-Methyl-N-(2-{[4-(methylsulfonyl)-2-nitrophenyl]amino}ethyl)-6-oxo-1,4,5,6-tetrahydro-3-pyridazinecarboxamide

  • Molecular FormulaC15H19N5O6S
  • Average mass397.406 Da
  • Monoisotopic mass397.105591 Da
  • ChemSpider ID22078384

More details:

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

1-Methyl-N-(2-{[4-(methylsulfonyl)-2-nitrophenyl]amino}ethyl)-6-oxo-1,4,5,6-tetrahydro-3-pyridazincarboxamid [German] [ACD/IUPAC Name]
1-Methyl-N-(2-{[4-(methylsulfonyl)-2-nitrophenyl]amino}ethyl)-6-oxo-1,4,5,6-tetrahydro-3-pyridazinecarboxamide [ACD/IUPAC Name]
1-Méthyl-N-(2-{[4-(méthylsulfonyl)-2-nitrophényl]amino}éthyl)-6-oxo-1,4,5,6-tétrahydro-3-pyridazinecarboxamide [French] [ACD/IUPAC Name]
3-Pyridazinecarboxamide, 1,4,5,6-tetrahydro-1-methyl-N-[2-[[4-(methylsulfonyl)-2-nitrophenyl]amino]ethyl]-6-oxo- [ACD/Index Name]

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: 1.663
Molar Refractivity: 96.4±0.5 cm3
#H bond acceptors: 11
#H bond donors: 2
#Freely Rotating Bonds: 7
#Rule of 5 Violations: 1
ACD/LogP: -1.29
ACD/LogD (pH 5.5): -0.58
ACD/BCF (pH 5.5): 1.00
ACD/KOC (pH 5.5): 11.47
ACD/LogD (pH 7.4): -0.59
ACD/BCF (pH 7.4): 1.00
ACD/KOC (pH 7.4): 11.42
Polar Surface Area: 162 Å2
Polarizability: 38.2±0.5 10-24cm3
Surface Tension: 65.3±7.0 dyne/cm
Molar Volume: 260.4±7.0 cm3

Click to predict properties on the Chemicalize site


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