ChemSpider 2D Image | 4-(4-Chlorophenyl)-N-[2-(3,4-dimethoxyphenyl)ethyl]-3-(1H-pyrrol-1-yl)-2-thiophenecarboxamide | C25H23ClN2O3S

4-(4-Chlorophenyl)-N-[2-(3,4-dimethoxyphenyl)ethyl]-3-(1H-pyrrol-1-yl)-2-thiophenecarboxamide

  • Molecular FormulaC25H23ClN2O3S
  • Average mass466.980 Da
  • Monoisotopic mass466.111786 Da
  • ChemSpider ID25184987

More details:

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

2-Thiophenecarboxamide, 4-(4-chlorophenyl)-N-[2-(3,4-dimethoxyphenyl)ethyl]-3-(1H-pyrrol-1-yl)- [ACD/Index Name]
4-(4-Chlorophenyl)-N-[2-(3,4-dimethoxyphenyl)ethyl]-3-(1H-pyrrol-1-yl)-2-thiophenecarboxamide [ACD/IUPAC Name]
4-(4-Chlorophényl)-N-[2-(3,4-diméthoxyphényl)éthyl]-3-(1H-pyrrol-1-yl)-2-thiophènecarboxamide [French] [ACD/IUPAC Name]
4-(4-Chlorphenyl)-N-[2-(3,4-dimethoxyphenyl)ethyl]-3-(1H-pyrrol-1-yl)-2-thiophencarboxamid [German] [ACD/IUPAC Name]
1291854-54-0 [RN]
4-(4-Chloro-phenyl)-3-pyrrol-1-yl-thiophene-2-carboxylic acid [2-(3,4-dimethoxy-phenyl)-ethyl]-amide
4-(4-chlorophenyl)-N-(3,4-dimethoxyphenethyl)-3-(1H-pyrrol-1-yl)thiophene-2-carboxamide
4-(4-chlorophenyl)-N-[2-(3,4-dimethoxyphenyl)ethyl]-3-(1H-pyrrol-1-yl)thiophene-2-carboxamide
MFCD18788661

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

Density: 1.3±0.1 g/cm3
Boiling Point: 616.7±55.0 °C at 760 mmHg
Vapour Pressure: 0.0±1.8 mmHg at 25°C
Enthalpy of Vaporization: 91.5±3.0 kJ/mol
Flash Point: 326.7±31.5 °C
Index of Refraction: 1.625
Molar Refractivity: 130.3±0.5 cm3
#H bond acceptors: 5
#H bond donors: 1
#Freely Rotating Bonds: 8
#Rule of 5 Violations: 1
ACD/LogP: 5.64
ACD/LogD (pH 5.5): 5.24
ACD/BCF (pH 5.5): 5667.90
ACD/KOC (pH 5.5): 16915.63
ACD/LogD (pH 7.4): 5.24
ACD/BCF (pH 7.4): 5657.89
ACD/KOC (pH 7.4): 16885.77
Polar Surface Area: 81 Å2
Polarizability: 51.6±0.5 10-24cm3
Surface Tension: 46.4±7.0 dyne/cm
Molar Volume: 368.5±7.0 cm3

Click to predict properties on the Chemicalize site


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