ChemSpider 2D Image | 1-(4-Butylphenyl)-5-methyl-N-[3-(4-morpholinyl)propyl]-1H-1,2,3-triazole-4-carboxamide | C21H31N5O2

1-(4-Butylphenyl)-5-methyl-N-[3-(4-morpholinyl)propyl]-1H-1,2,3-triazole-4-carboxamide

  • Molecular FormulaC21H31N5O2
  • Average mass385.503 Da
  • Monoisotopic mass385.247772 Da
  • ChemSpider ID21636291

More details:

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

1-(4-Butylphenyl)-5-methyl-N-[3-(4-morpholinyl)propyl]-1H-1,2,3-triazol-4-carboxamid [German] [ACD/IUPAC Name]
1-(4-Butylphenyl)-5-methyl-N-[3-(4-morpholinyl)propyl]-1H-1,2,3-triazole-4-carboxamide [ACD/IUPAC Name]
1-(4-Butylphényl)-5-méthyl-N-[3-(4-morpholinyl)propyl]-1H-1,2,3-triazole-4-carboxamide [French] [ACD/IUPAC Name]
1-(4-butylphenyl)-5-methyl-N-[3-(morpholin-4-yl)propyl]-1H-1,2,3-triazole-4-carboxamide
1H-1,2,3-Triazole-4-carboxamide, 1-(4-butylphenyl)-5-methyl-N-[3-(4-morpholinyl)propyl]- [ACD/Index Name]
1-(4-Butyl-phenyl)-5-methyl-1H-[1,2,3]triazole-4-carboxylic acid (3-morpholin-4-yl-propyl)-amide
1-(4-butylphenyl)-5-methyl-N-(3-morpholin-4-ylpropyl)triazole-4-carboxamide
1-(4-butylphenyl)-5-methyl-N-(3-morpholinopropyl)-1H-1,2,3-triazole-4-carboxamide
950253-37-9 [RN]
MFCD09874352

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

Density: 1.2±0.1 g/cm3
Boiling Point:
Vapour Pressure:
Enthalpy of Vaporization:
Flash Point:
Index of Refraction: 1.602
Molar Refractivity: 110.6±0.5 cm3
#H bond acceptors: 7
#H bond donors: 1
#Freely Rotating Bonds: 9
#Rule of 5 Violations: 0
ACD/LogP: 2.93
ACD/LogD (pH 5.5): 1.20
ACD/BCF (pH 5.5): 1.95
ACD/KOC (pH 5.5): 19.18
ACD/LogD (pH 7.4): 2.65
ACD/BCF (pH 7.4): 54.84
ACD/KOC (pH 7.4): 539.21
Polar Surface Area: 72 Å2
Polarizability: 43.9±0.5 10-24cm3
Surface Tension: 45.5±7.0 dyne/cm
Molar Volume: 322.7±7.0 cm3

Click to predict properties on the Chemicalize site


Advertisement