ChemSpider 2D Image | 5-{2-(sec-Butylsulfamoyl)-4-[(3-methoxybenzoyl)amino]phenoxy}-1-isopropyl-4-methyl-1H-pyrazole-3-carboxylic acid | C26H32N4O7S

5-{2-(sec-Butylsulfamoyl)-4-[(3-methoxybenzoyl)amino]phenoxy}-1-isopropyl-4-methyl-1H-pyrazole-3-carboxylic acid

  • Molecular FormulaC26H32N4O7S
  • Average mass544.620 Da
  • Monoisotopic mass544.199158 Da
  • ChemSpider ID29265716

More details:

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

1H-Pyrazole-3-carboxylic acid, 5-[4-[(3-methoxybenzoyl)amino]-2-[[(1-methylpropyl)amino]sulfonyl]phenoxy]-4-methyl-1-(1-methylethyl)- [ACD/Index Name]
5-{2-(sec-Butylsulfamoyl)-4-[(3-methoxybenzoyl)amino]phenoxy}-1-isopropyl-4-methyl-1H-pyrazol-3-carbonsäure [German] [ACD/IUPAC Name]
5-{2-(sec-Butylsulfamoyl)-4-[(3-methoxybenzoyl)amino]phenoxy}-1-isopropyl-4-methyl-1H-pyrazole-3-carboxylic acid [ACD/IUPAC Name]
Acide 5-{2-(sec-butylsulfamoyl)-4-[(3-méthoxybenzoyl)amino]phénoxy}-1-isopropyl-4-méthyl-1H-pyrazole-3-carboxylique [French] [ACD/IUPAC Name]

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

Density: 1.3±0.1 g/cm3
Boiling Point:
Vapour Pressure:
Enthalpy of Vaporization:
Flash Point:
Index of Refraction: 1.609
Molar Refractivity: 141.8±0.5 cm3
#H bond acceptors: 11
#H bond donors: 3
#Freely Rotating Bonds: 11
#Rule of 5 Violations: 2
ACD/LogP: 3.76
ACD/LogD (pH 5.5): 2.16
ACD/BCF (pH 5.5): 9.43
ACD/KOC (pH 5.5): 52.37
ACD/LogD (pH 7.4): 0.94
ACD/BCF (pH 7.4): 1.00
ACD/KOC (pH 7.4): 3.14
Polar Surface Area: 157 Å2
Polarizability: 56.2±0.5 10-24cm3
Surface Tension: 48.0±7.0 dyne/cm
Molar Volume: 409.8±7.0 cm3

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