ChemSpider 2D Image | N-[(2Z)-3-(4-Chlorophenyl)-4-methyl-1,3-thiazol-2(3H)-ylidene]-1-methyl-1H-pyrazole-4-carboxamide | C15H13ClN4OS

N-[(2Z)-3-(4-Chlorophenyl)-4-methyl-1,3-thiazol-2(3H)-ylidene]-1-methyl-1H-pyrazole-4-carboxamide

  • Molecular FormulaC15H13ClN4OS
  • Average mass332.808 Da
  • Monoisotopic mass332.049866 Da
  • ChemSpider ID26629579

  • Double-bond stereo - Double-bond stereo

More details:

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

1H-Pyrazole-4-carboxamide, N-[(2Z)-3-(4-chlorophenyl)-4-methyl-2(3H)-thiazolylidene]-1-methyl- [ACD/Index Name]
N-[(2Z)-3-(4-Chlorophenyl)-4-methyl-1,3-thiazol-2(3H)-ylidene]-1-methyl-1H-pyrazole-4-carboxamide [ACD/IUPAC Name]
N-[(2Z)-3-(4-Chlorophényl)-4-méthyl-1,3-thiazol-2(3H)-ylidène]-1-méthyl-1H-pyrazole-4-carboxamide [French] [ACD/IUPAC Name]
N-[(2Z)-3-(4-Chlorphenyl)-4-methyl-1,3-thiazol-2(3H)-yliden]-1-methyl-1H-pyrazol-4-carboxamid [German] [ACD/IUPAC 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: 512.2±56.0 °C at 760 mmHg
Vapour Pressure: 0.0±1.3 mmHg at 25°C
Enthalpy of Vaporization: 78.3±3.0 kJ/mol
Flash Point: 263.6±31.8 °C
Index of Refraction: 1.686
Molar Refractivity: 90.9±0.5 cm3
#H bond acceptors: 5
#H bond donors: 0
#Freely Rotating Bonds: 3
#Rule of 5 Violations: 0
ACD/LogP: 3.32
ACD/LogD (pH 5.5): 2.88
ACD/BCF (pH 5.5): 90.37
ACD/KOC (pH 5.5): 874.46
ACD/LogD (pH 7.4): 2.88
ACD/BCF (pH 7.4): 90.37
ACD/KOC (pH 7.4): 874.46
Polar Surface Area: 76 Å2
Polarizability: 36.1±0.5 10-24cm3
Surface Tension: 53.4±7.0 dyne/cm
Molar Volume: 238.9±7.0 cm3

Click to predict properties on the Chemicalize site


Advertisement