ChemSpider 2D Image | 2-(3,4-Dimethyl-5,5-dioxidopyrazolo[4,3-c][1,2]benzothiazin-2(4H)-yl)-1-(4-methoxyphenyl)ethanone | C20H19N3O4S

2-(3,4-Dimethyl-5,5-dioxidopyrazolo[4,3-c][1,2]benzothiazin-2(4H)-yl)-1-(4-methoxyphenyl)ethanone

  • Molecular FormulaC20H19N3O4S
  • Average mass397.448 Da
  • Monoisotopic mass397.109619 Da
  • ChemSpider ID30657431

More details:

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

2-(3,4-Dimethyl-5,5-dioxidopyrazolo[4,3-c][1,2]benzothiazin-2(4H)-yl)-1-(4-methoxyphenyl)ethanon [German] [ACD/IUPAC Name]
2-(3,4-Dimethyl-5,5-dioxidopyrazolo[4,3-c][1,2]benzothiazin-2(4H)-yl)-1-(4-methoxyphenyl)ethanone [ACD/IUPAC Name]
2-(3,4-Diméthyl-5,5-dioxydopyrazolo[4,3-c][1,2]benzothiazin-2(4H)-yl)-1-(4-méthoxyphényl)éthanone [French] [ACD/IUPAC Name]
Ethanone, 2-(3,4-dimethyl-5,5-dioxidopyrazolo[4,3-c][1,2]benzothiazin-2(4H)-yl)-1-(4-methoxyphenyl)- [ACD/Index Name]

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

Density: 1.4±0.1 g/cm3
Boiling Point: 661.9±65.0 °C at 760 mmHg
Vapour Pressure: 0.0±2.0 mmHg at 25°C
Enthalpy of Vaporization: 97.4±3.0 kJ/mol
Flash Point: 354.1±34.3 °C
Index of Refraction: 1.664
Molar Refractivity: 106.9±0.5 cm3
#H bond acceptors: 7
#H bond donors: 0
#Freely Rotating Bonds: 4
#Rule of 5 Violations: 0
ACD/LogP: 2.10
ACD/LogD (pH 5.5): 2.24
ACD/BCF (pH 5.5): 29.45
ACD/KOC (pH 5.5): 391.90
ACD/LogD (pH 7.4): 2.24
ACD/BCF (pH 7.4): 29.45
ACD/KOC (pH 7.4): 391.90
Polar Surface Area: 90 Å2
Polarizability: 42.4±0.5 10-24cm3
Surface Tension: 53.4±7.0 dyne/cm
Molar Volume: 288.1±7.0 cm3

Click to predict properties on the Chemicalize site


Advertisement