ChemSpider 2D Image | 2-{[(3,4-Dimethoxyphenyl)sulfonyl]amino}-4-(3-nitrophenyl)-1,3-thiazole-5-carboxylic acid | C18H15N3O8S2

2-{[(3,4-Dimethoxyphenyl)sulfonyl]amino}-4-(3-nitrophenyl)-1,3-thiazole-5-carboxylic acid

  • Molecular FormulaC18H15N3O8S2
  • Average mass465.457 Da
  • Monoisotopic mass465.030060 Da
  • ChemSpider ID58972129

More details:

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

2-{[(3,4-Dimethoxyphenyl)sulfonyl]amino}-4-(3-nitrophenyl)-1,3-thiazol-5-carbonsäure [German] [ACD/IUPAC Name]
2-{[(3,4-Dimethoxyphenyl)sulfonyl]amino}-4-(3-nitrophenyl)-1,3-thiazole-5-carboxylic acid [ACD/IUPAC Name]
5-Thiazolecarboxylic acid, 2-[[(3,4-dimethoxyphenyl)sulfonyl]amino]-4-(3-nitrophenyl)- [ACD/Index Name]
Acide 2-{[(3,4-diméthoxyphényl)sulfonyl]amino}-4-(3-nitrophényl)-1,3-thiazole-5-carboxylique [French] [ACD/IUPAC Name]

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

Density: 1.6±0.1 g/cm3
Boiling Point: 686.7±65.0 °C at 760 mmHg
Vapour Pressure: 0.0±2.2 mmHg at 25°C
Enthalpy of Vaporization: 105.7±3.0 kJ/mol
Flash Point: 369.1±34.3 °C
Index of Refraction: 1.654
Molar Refractivity: 109.6±0.4 cm3
#H bond acceptors: 11
#H bond donors: 2
#Freely Rotating Bonds: 8
#Rule of 5 Violations: 1
ACD/LogP: 2.40
ACD/LogD (pH 5.5): -0.22
ACD/BCF (pH 5.5): 1.00
ACD/KOC (pH 5.5): 1.00
ACD/LogD (pH 7.4): -1.23
ACD/BCF (pH 7.4): 1.00
ACD/KOC (pH 7.4): 1.00
Polar Surface Area: 197 Å2
Polarizability: 43.5±0.5 10-24cm3
Surface Tension: 72.6±3.0 dyne/cm
Molar Volume: 298.9±3.0 cm3

Click to predict properties on the Chemicalize site


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