ChemSpider 2D Image | N-[4-({2-[6-Oxo-3-(1H-1,2,4-triazol-1-yl)-1(6H)-pyridazinyl]ethyl}sulfamoyl)phenyl]butanamide | C18H21N7O4S

N-[4-({2-[6-Oxo-3-(1H-1,2,4-triazol-1-yl)-1(6H)-pyridazinyl]ethyl}sulfamoyl)phenyl]butanamide

  • Molecular FormulaC18H21N7O4S
  • Average mass431.469 Da
  • Monoisotopic mass431.137573 Da
  • ChemSpider ID30758607

More details:






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

Butanamide, N-[4-[[[2-[6-oxo-3-(1H-1,2,4-triazol-1-yl)-1(6H)-pyridazinyl]ethyl]amino]sulfonyl]phenyl]- [ACD/Index Name]
N-[4-({2-[6-Oxo-3-(1H-1,2,4-triazol-1-yl)-1(6H)-pyridazinyl]ethyl}sulfamoyl)phenyl]butanamid [German] [ACD/IUPAC Name]
N-[4-({2-[6-Oxo-3-(1H-1,2,4-triazol-1-yl)-1(6H)-pyridazinyl]ethyl}sulfamoyl)phenyl]butanamide [ACD/IUPAC Name]
N-[4-({2-[6-Oxo-3-(1H-1,2,4-triazol-1-yl)-1(6H)-pyridazinyl]éthyl}sulfamoyl)phényl]butanamide [French] [ACD/IUPAC Name]
1448035-00-4 [RN]
N-(4-(N-(2-(6-oxo-3-(1H-1,2,4-triazol-1-yl)pyridazin-1(6H)-yl)ethyl)sulfamoyl)phenyl)butyramide

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: 1.684
Molar Refractivity: 112.3±0.5 cm3
#H bond acceptors: 11
#H bond donors: 2
#Freely Rotating Bonds: 9
#Rule of 5 Violations: 1
ACD/LogP: -0.01
ACD/LogD (pH 5.5): -0.08
ACD/BCF (pH 5.5): 1.00
ACD/KOC (pH 5.5): 21.59
ACD/LogD (pH 7.4): -0.08
ACD/BCF (pH 7.4): 1.00
ACD/KOC (pH 7.4): 21.58
Polar Surface Area: 147 Å2
Polarizability: 44.5±0.5 10-24cm3
Surface Tension: 64.1±7.0 dyne/cm
Molar Volume: 295.8±7.0 cm3

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