ChemSpider 2D Image | N-[2-(3,4-Dimethoxyphenyl)ethyl]-N-methyl-2-[(2-{[(2-methylbenzoyl)(propyl)amino]methyl}-1H-pyrrol-1-yl)methyl]-1,3-thiazole-4-carboxamide | C32H38N4O4S

N-[2-(3,4-Dimethoxyphenyl)ethyl]-N-methyl-2-[(2-{[(2-methylbenzoyl)(propyl)amino]methyl}-1H-pyrrol-1-yl)methyl]-1,3-thiazole-4-carboxamide

  • Molecular FormulaC32H38N4O4S
  • Average mass574.734 Da
  • Monoisotopic mass574.261353 Da
  • ChemSpider ID3153565

More details:

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

4-Thiazolecarboxamide, N-[2-(3,4-dimethoxyphenyl)ethyl]-N-methyl-2-[[2-[[(2-methylbenzoyl)propylamino]methyl]-1H-pyrrol-1-yl]methyl]- [ACD/Index Name]
N-[2-(3,4-Dimethoxyphenyl)ethyl]-N-methyl-2-[(2-{[(2-methylbenzoyl)(propyl)amino]methyl}-1H-pyrrol-1-yl)methyl]-1,3-thiazol-4-carboxamid [German] [ACD/IUPAC Name]
N-[2-(3,4-Dimethoxyphenyl)ethyl]-N-methyl-2-[(2-{[(2-methylbenzoyl)(propyl)amino]methyl}-1H-pyrrol-1-yl)methyl]-1,3-thiazole-4-carboxamide [ACD/IUPAC Name]
N-[2-(3,4-Diméthoxyphényl)éthyl]-N-méthyl-2-[(2-{[(2-méthylbenzoyl)(propyl)amino]méthyl}-1H-pyrrol-1-yl)méthyl]-1,3-thiazole-4-carboxamide [French] [ACD/IUPAC Name]

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

Density: 1.2±0.1 g/cm3
Boiling Point: 766.2±60.0 °C at 760 mmHg
Vapour Pressure: 0.0±2.6 mmHg at 25°C
Enthalpy of Vaporization: 111.6±3.0 kJ/mol
Flash Point: 417.2±32.9 °C
Index of Refraction: 1.597
Molar Refractivity: 166.1±0.5 cm3
#H bond acceptors: 8
#H bond donors: 0
#Freely Rotating Bonds: 13
#Rule of 5 Violations: 1
ACD/LogP: 3.85
ACD/LogD (pH 5.5): 4.18
ACD/BCF (pH 5.5): 883.42
ACD/KOC (pH 5.5): 4471.64
ACD/LogD (pH 7.4): 4.18
ACD/BCF (pH 7.4): 883.42
ACD/KOC (pH 7.4): 4471.65
Polar Surface Area: 105 Å2
Polarizability: 65.9±0.5 10-24cm3
Surface Tension: 43.8±7.0 dyne/cm
Molar Volume: 487.6±7.0 cm3

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