ChemSpider 2D Image | 4-[(4-{[2-(4-Chlorophenyl)-1,3-thiazol-4-yl]carbonyl}-1-piperazinyl)sulfonyl]-1-methyl-1H-pyrrole-2-carboxamide | C20H20ClN5O4S2

4-[(4-{[2-(4-Chlorophenyl)-1,3-thiazol-4-yl]carbonyl}-1-piperazinyl)sulfonyl]-1-methyl-1H-pyrrole-2-carboxamide

  • Molecular FormulaC20H20ClN5O4S2
  • Average mass493.987 Da
  • Monoisotopic mass493.064514 Da
  • ChemSpider ID22083470

More details:

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

1H-Pyrrole-2-carboxamide, 4-[[4-[[2-(4-chlorophenyl)-4-thiazolyl]carbonyl]-1-piperazinyl]sulfonyl]-1-methyl- [ACD/Index Name]
4-[(4-{[2-(4-Chlorophenyl)-1,3-thiazol-4-yl]carbonyl}-1-piperazinyl)sulfonyl]-1-methyl-1H-pyrrole-2-carboxamide [ACD/IUPAC Name]
4-[(4-{[2-(4-Chlorophényl)-1,3-thiazol-4-yl]carbonyl}-1-pipérazinyl)sulfonyl]-1-méthyl-1H-pyrrole-2-carboxamide [French] [ACD/IUPAC Name]
4-[(4-{[2-(4-Chlorphenyl)-1,3-thiazol-4-yl]carbonyl}-1-piperazinyl)sulfonyl]-1-methyl-1H-pyrrol-2-carboxamid [German] [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: 749.9±70.0 °C at 760 mmHg
Vapour Pressure: 0.0±2.5 mmHg at 25°C
Enthalpy of Vaporization: 109.3±3.0 kJ/mol
Flash Point: 407.4±35.7 °C
Index of Refraction: 1.734
Molar Refractivity: 125.0±0.5 cm3
#H bond acceptors: 9
#H bond donors: 2
#Freely Rotating Bonds: 5
#Rule of 5 Violations: 0
ACD/LogP: 2.03
ACD/LogD (pH 5.5): 1.72
ACD/BCF (pH 5.5): 11.87
ACD/KOC (pH 5.5): 204.46
ACD/LogD (pH 7.4): 1.72
ACD/BCF (pH 7.4): 11.87
ACD/KOC (pH 7.4): 204.47
Polar Surface Area: 155 Å2
Polarizability: 49.6±0.5 10-24cm3
Surface Tension: 69.3±7.0 dyne/cm
Molar Volume: 311.9±7.0 cm3

Click to predict properties on the Chemicalize site


Advertisement