ChemSpider 2D Image | Ethyl 3-(7-ethoxy-6-{[(4-methoxyphenyl)sulfonyl]amino}-2H-indazol-2-yl)propanoate | C21H25N3O6S

Ethyl 3-(7-ethoxy-6-{[(4-methoxyphenyl)sulfonyl]amino}-2H-indazol-2-yl)propanoate

  • Molecular FormulaC21H25N3O6S
  • Average mass447.505 Da
  • Monoisotopic mass447.146393 Da
  • ChemSpider ID30657587

More details:

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

2H-Indazole-2-propanoic acid, 7-ethoxy-6-[[(4-methoxyphenyl)sulfonyl]amino]-, ethyl ester [ACD/Index Name]
3-(7-Éthoxy-6-{[(4-méthoxyphényl)sulfonyl]amino}-2H-indazol-2-yl)propanoate d'éthyle [French] [ACD/IUPAC Name]
Ethyl 3-(7-ethoxy-6-{[(4-methoxyphenyl)sulfonyl]amino}-2H-indazol-2-yl)propanoate [ACD/IUPAC Name]
Ethyl-3-(7-ethoxy-6-{[(4-methoxyphenyl)sulfonyl]amino}-2H-indazol-2-yl)propanoat [German] [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: 636.6±65.0 °C at 760 mmHg
Vapour Pressure: 0.0±1.9 mmHg at 25°C
Enthalpy of Vaporization: 94.1±3.0 kJ/mol
Flash Point: 338.8±34.3 °C
Index of Refraction: 1.599
Molar Refractivity: 116.0±0.5 cm3
#H bond acceptors: 9
#H bond donors: 1
#Freely Rotating Bonds: 11
#Rule of 5 Violations: 0
ACD/LogP: 4.03
ACD/LogD (pH 5.5): 3.20
ACD/BCF (pH 5.5): 159.59
ACD/KOC (pH 5.5): 1313.05
ACD/LogD (pH 7.4): 3.14
ACD/BCF (pH 7.4): 139.34
ACD/KOC (pH 7.4): 1146.48
Polar Surface Area: 117 Å2
Polarizability: 46.0±0.5 10-24cm3
Surface Tension: 48.5±7.0 dyne/cm
Molar Volume: 339.5±7.0 cm3

Click to predict properties on the Chemicalize site


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