ChemSpider 2D Image | N,N-Diethyl-1-{[1-(3,4,5-trimethoxybenzoyl)-3-piperidinyl]methyl}-1H-1,2,3-triazole-4-carboxamide | C23H33N5O5

N,N-Diethyl-1-{[1-(3,4,5-trimethoxybenzoyl)-3-piperidinyl]methyl}-1H-1,2,3-triazole-4-carboxamide

  • Molecular FormulaC23H33N5O5
  • Average mass459.539 Da
  • Monoisotopic mass459.248169 Da
  • ChemSpider ID22242905

More details:

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

1H-1,2,3-Triazole-4-carboxamide, N,N-diethyl-1-[[1-(3,4,5-trimethoxybenzoyl)-3-piperidinyl]methyl]- [ACD/Index Name]
N,N-Diethyl-1-{[1-(3,4,5-trimethoxybenzoyl)-3-piperidinyl]methyl}-1H-1,2,3-triazol-4-carboxamid [German] [ACD/IUPAC Name]
N,N-Diethyl-1-{[1-(3,4,5-trimethoxybenzoyl)-3-piperidinyl]methyl}-1H-1,2,3-triazole-4-carboxamide [ACD/IUPAC Name]
N,N-Diéthyl-1-{[1-(3,4,5-triméthoxybenzoyl)-3-pipéridinyl]méthyl}-1H-1,2,3-triazole-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: 671.5±65.0 °C at 760 mmHg
Vapour Pressure: 0.0±2.1 mmHg at 25°C
Enthalpy of Vaporization: 98.7±3.0 kJ/mol
Flash Point: 359.9±34.3 °C
Index of Refraction: 1.587
Molar Refractivity: 123.8±0.5 cm3
#H bond acceptors: 10
#H bond donors: 0
#Freely Rotating Bonds: 9
#Rule of 5 Violations: 1
ACD/LogP: 1.18
ACD/LogD (pH 5.5): 1.34
ACD/BCF (pH 5.5): 6.19
ACD/KOC (pH 5.5): 128.32
ACD/LogD (pH 7.4): 1.34
ACD/BCF (pH 7.4): 6.19
ACD/KOC (pH 7.4): 128.32
Polar Surface Area: 99 Å2
Polarizability: 49.1±0.5 10-24cm3
Surface Tension: 44.4±7.0 dyne/cm
Molar Volume: 368.4±7.0 cm3

Click to predict properties on the Chemicalize site


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