ChemSpider 2D Image | (1,5-Dimethyl-3-oxo-2-phenyl-2,3-dihydro-1H-pyrazol-4-yl)({4-[(6-methoxy-3-pyridazinyl)sulfamoyl]phenyl}amino)methanesulfonate | C23H23N6O7S2

(1,5-Dimethyl-3-oxo-2-phenyl-2,3-dihydro-1H-pyrazol-4-yl)({4-[(6-methoxy-3-pyridazinyl)sulfamoyl]phenyl}amino)methanesulfonate

  • Molecular FormulaC23H23N6O7S2
  • Average mass559.595 Da
  • Monoisotopic mass559.107483 Da
  • ChemSpider ID95760461

  • Charge - Charge

More details:

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

(1,5-Dimethyl-3-oxo-2-phenyl-2,3-dihydro-1H-pyrazol-4-yl)({4-[(6-methoxy-3-pyridazinyl)sulfamoyl]phenyl}amino)methanesulfonate [ACD/IUPAC Name]
(1,5-Diméthyl-3-oxo-2-phényl-2,3-dihydro-1H-pyrazol-4-yl)({4-[(6-méthoxy-3-pyridazinyl)sulfamoyl]phényl}amino)méthanesulfonate [French] [ACD/IUPAC Name]
(1,5-Dimethyl-3-oxo-2-phenyl-2,3-dihydro-1H-pyrazol-4-yl)({4-[(6-methoxy-3-pyridazinyl)sulfamoyl]phenyl}amino)methansulfonat [German] [ACD/IUPAC Name]
1H-Pyrazole-4-methanesulfonic acid, 2,3-dihydro-α-[[4-[[(6-methoxy-3-pyridazinyl)amino]sulfonyl]phenyl]amino]-1,5-dimethyl-3-oxo-2-phenyl-, ion(1-) [ACD/Index Name]

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

Density:
Boiling Point:
Vapour Pressure:
Enthalpy of Vaporization:
Flash Point:
Index of Refraction:
Molar Refractivity:
#H bond acceptors: 13
#H bond donors: 3
#Freely Rotating Bonds: 9
#Rule of 5 Violations: 2
ACD/LogP: 0.12
ACD/LogD (pH 5.5): -3.97
ACD/BCF (pH 5.5): 1.00
ACD/KOC (pH 5.5): 1.00
ACD/LogD (pH 7.4): -4.59
ACD/BCF (pH 7.4): 1.00
ACD/KOC (pH 7.4): 1.00
Polar Surface Area: 191 Å2
Polarizability:
Surface Tension:
Molar Volume:

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