ChemSpider 2D Image | 4-{[3-(3,5-Dimethyl-1H-pyrazol-1-yl)-3-oxopropyl]amino}benzenesulfonamide | C14H18N4O3S

4-{[3-(3,5-Dimethyl-1H-pyrazol-1-yl)-3-oxopropyl]amino}benzenesulfonamide

  • Molecular FormulaC14H18N4O3S
  • Average mass322.383 Da
  • Monoisotopic mass322.109955 Da
  • ChemSpider ID35033976

More details:

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

4-{[3-(3,5-Dimethyl-1H-pyrazol-1-yl)-3-oxopropyl]amino}benzenesulfonamide [ACD/IUPAC Name]
4-{[3-(3,5-Diméthyl-1H-pyrazol-1-yl)-3-oxopropyl]amino}benzènesulfonamide [French] [ACD/IUPAC Name]
4-{[3-(3,5-Dimethyl-1H-pyrazol-1-yl)-3-oxopropyl]amino}benzolsulfonamid [German] [ACD/IUPAC Name]
Benzenesulfonamide, 4-[[3-(3,5-dimethyl-1H-pyrazol-1-yl)-3-oxopropyl]amino]- [ACD/Index Name]
KR5

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

Density: 1.4±0.1 g/cm3
Boiling Point: 583.0±60.0 °C at 760 mmHg
Vapour Pressure: 0.0±1.6 mmHg at 25°C
Enthalpy of Vaporization: 87.1±3.0 kJ/mol
Flash Point: 306.4±32.9 °C
Index of Refraction: 1.639
Molar Refractivity: 84.2±0.5 cm3
#H bond acceptors: 7
#H bond donors: 3
#Freely Rotating Bonds: 5
#Rule of 5 Violations: 0
ACD/LogP: 1.32
ACD/LogD (pH 5.5): 1.23
ACD/BCF (pH 5.5): 5.10
ACD/KOC (pH 5.5): 111.76
ACD/LogD (pH 7.4): 1.23
ACD/BCF (pH 7.4): 5.10
ACD/KOC (pH 7.4): 111.68
Polar Surface Area: 115 Å2
Polarizability: 33.4±0.5 10-24cm3
Surface Tension: 55.4±7.0 dyne/cm
Molar Volume: 233.8±7.0 cm3

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