ChemSpider 2D Image | N-(2,4-Dimethoxyphenyl)-2-{[(2-ethyl-1-piperidinyl)acetyl]amino}-6-(2-methyl-2-propanyl)-4,5,6,7-tetrahydro-1-benzothiophene-3-carboxamide | C30H43N3O4S

N-(2,4-Dimethoxyphenyl)-2-{[(2-ethyl-1-piperidinyl)acetyl]amino}-6-(2-methyl-2-propanyl)-4,5,6,7-tetrahydro-1-benzothiophene-3-carboxamide

  • Molecular FormulaC30H43N3O4S
  • Average mass541.745 Da
  • Monoisotopic mass541.297424 Da
  • ChemSpider ID3641233

More details:

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

1-Piperidineacetamide, N-[3-[[(2,4-dimethoxyphenyl)amino]carbonyl]-6-(1,1-dimethylethyl)-4,5,6,7-tetrahydrobenzo[b]thien-2-yl]-2-ethyl- [ACD/Index Name]
N-(2,4-Dimethoxyphenyl)-2-{[(2-ethyl-1-piperidinyl)acetyl]amino}-6-(2-methyl-2-propanyl)-4,5,6,7-tetrahydro-1-benzothiophen-3-carboxamid [German] [ACD/IUPAC Name]
N-(2,4-Dimethoxyphenyl)-2-{[(2-ethyl-1-piperidinyl)acetyl]amino}-6-(2-methyl-2-propanyl)-4,5,6,7-tetrahydro-1-benzothiophene-3-carboxamide [ACD/IUPAC Name]
N-(2,4-Diméthoxyphényl)-2-{[2-(2-éthyl-1-pipéridinyl)acétyl]amino}-6-(2-méthyl-2-propanyl)-4,5,6,7-tétrahydro-1-benzothiophène-3-carboxamide [French] [ACD/IUPAC Name]
6-tert-Butyl-2-[2-(2-ethyl-piperidin-1-yl)-acetylamino]-4,5,6,7-tetrahydro-benzo[b]thiophene-3-carboxylic acid (2,4-dimethoxy-phenyl)-amide
6-tert-butyl-N-(2,4-dimethoxyphenyl)-2-[2-(2-ethylpiperidin-1-yl)acetamido]-4,5,6,7-tetrahydro-1-benzothiophene-3-carboxamide
6-tert-butyl-N-(2,4-dimethoxyphenyl)-2-{[(2-ethylpiperidin-1-yl)acetyl]amino}-4,5,6,7-tetrahydro-1-benzothiophene-3-carboxamide

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

Density: 1.2±0.1 g/cm3
Boiling Point: 658.5±55.0 °C at 760 mmHg
Vapour Pressure: 0.0±2.0 mmHg at 25°C
Enthalpy of Vaporization: 96.9±3.0 kJ/mol
Flash Point: 352.0±31.5 °C
Index of Refraction: 1.588
Molar Refractivity: 155.8±0.3 cm3
#H bond acceptors: 7
#H bond donors: 2
#Freely Rotating Bonds: 9
#Rule of 5 Violations: 2
ACD/LogP: 8.26
ACD/LogD (pH 5.5): 5.12
ACD/BCF (pH 5.5): 1537.05
ACD/KOC (pH 5.5): 1813.36
ACD/LogD (pH 7.4): 6.75
ACD/BCF (pH 7.4): 64544.50
ACD/KOC (pH 7.4): 76147.51
Polar Surface Area: 108 Å2
Polarizability: 61.8±0.5 10-24cm3
Surface Tension: 48.5±3.0 dyne/cm
Molar Volume: 463.1±3.0 cm3

Click to predict properties on the Chemicalize site


Advertisement