ChemSpider 2D Image | 3-Chloro-6-methyl-N-[1-(4-pyridinyl)ethyl]-1-benzothiophene-2-carboxamide | C17H15ClN2OS

3-Chloro-6-methyl-N-[1-(4-pyridinyl)ethyl]-1-benzothiophene-2-carboxamide

  • Molecular FormulaC17H15ClN2OS
  • Average mass330.832 Da
  • Monoisotopic mass330.059357 Da
  • ChemSpider ID21797876

More details:

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

3-Chlor-6-methyl-N-[1-(4-pyridinyl)ethyl]-1-benzothiophen-2-carboxamid [German] [ACD/IUPAC Name]
3-Chloro-6-methyl-N-[1-(4-pyridinyl)ethyl]-1-benzothiophene-2-carboxamide [ACD/IUPAC Name]
3-Chloro-6-méthyl-N-[1-(4-pyridinyl)éthyl]-1-benzothiophène-2-carboxamide [French] [ACD/IUPAC Name]
Benzo[b]thiophene-2-carboxamide, 3-chloro-6-methyl-N-[1-(4-pyridinyl)ethyl]- [ACD/Index Name]
(3-chloro-6-methylbenzo[b]thiophen-2-yl)-N-(4-pyridylethyl)carboxamide
3-Chloro-6-methyl-benzo[b]thiophene-2-carboxylic acid (1-pyridin-4-yl-ethyl)-amide
3-chloro-6-methyl-N-[1-(pyridin-4-yl)ethyl]-1-benzothiophene-2-carboxamide
MFCD09873390

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

Density: 1.3±0.1 g/cm3
Boiling Point: 550.8±50.0 °C at 760 mmHg
Vapour Pressure: 0.0±1.5 mmHg at 25°C
Enthalpy of Vaporization: 83.1±3.0 kJ/mol
Flash Point: 286.9±30.1 °C
Index of Refraction: 1.657
Molar Refractivity: 93.0±0.3 cm3
#H bond acceptors: 3
#H bond donors: 1
#Freely Rotating Bonds: 3
#Rule of 5 Violations: 0
ACD/LogP: 4.52
ACD/LogD (pH 5.5): 3.78
ACD/BCF (pH 5.5): 365.56
ACD/KOC (pH 5.5): 1915.06
ACD/LogD (pH 7.4): 4.10
ACD/BCF (pH 7.4): 771.69
ACD/KOC (pH 7.4): 4042.61
Polar Surface Area: 70 Å2
Polarizability: 36.9±0.5 10-24cm3
Surface Tension: 54.1±3.0 dyne/cm
Molar Volume: 252.8±3.0 cm3

Click to predict properties on the Chemicalize site


Advertisement