ChemSpider 2D Image | 4-Bromo-N-[1-(2-thienylmethyl)-1H-pyrazol-5-yl]benzamide | C15H12BrN3OS

4-Bromo-N-[1-(2-thienylmethyl)-1H-pyrazol-5-yl]benzamide

  • Molecular FormulaC15H12BrN3OS
  • Average mass362.244 Da
  • Monoisotopic mass360.988434 Da
  • ChemSpider ID16875752

More details:

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

4-Brom-N-[1-(2-thienylmethyl)-1H-pyrazol-5-yl]benzamid [German] [ACD/IUPAC Name]
4-Bromo-N-[1-(2-thienylmethyl)-1H-pyrazol-5-yl]benzamide [ACD/IUPAC Name]
4-Bromo-N-[1-(2-thiénylméthyl)-1H-pyrazol-5-yl]benzamide [French] [ACD/IUPAC Name]
Benzamide, 4-bromo-N-[1-(2-thienylmethyl)-1H-pyrazol-5-yl]- [ACD/Index Name]
(4-bromophenyl)-N-[1-(2-thienylmethyl)pyrazol-5-yl]carboxamide
1052612-00-6 [RN]
4-bromo-N-[1-(thiophen-2-ylmethyl)-1H-pyrazol-5-yl]benzamide
4-bromo-N-[2-(thiophen-2-ylmethyl)pyrazol-3-yl]benzamide
4-bromo-N-{1-[(thiophen-2-yl)methyl]-1H-pyrazol-5-yl}benzamide

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

Density: 1.6±0.1 g/cm3
Boiling Point: 451.2±40.0 °C at 760 mmHg
Vapour Pressure: 0.0±1.1 mmHg at 25°C
Enthalpy of Vaporization: 71.0±3.0 kJ/mol
Flash Point: 226.7±27.3 °C
Index of Refraction: 1.702
Molar Refractivity: 90.3±0.5 cm3
#H bond acceptors: 4
#H bond donors: 1
#Freely Rotating Bonds: 4
#Rule of 5 Violations: 0
ACD/LogP: 3.47
ACD/LogD (pH 5.5): 3.48
ACD/BCF (pH 5.5): 260.39
ACD/KOC (pH 5.5): 1865.01
ACD/LogD (pH 7.4): 3.48
ACD/BCF (pH 7.4): 260.44
ACD/KOC (pH 7.4): 1865.38
Polar Surface Area: 75 Å2
Polarizability: 35.8±0.5 10-24cm3
Surface Tension: 57.3±7.0 dyne/cm
Molar Volume: 233.1±7.0 cm3

Click to predict properties on the Chemicalize site


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