ChemSpider 2D Image | N~2~-Acetyl-N-[2-(5-amino-1H-1,2,4-triazol-3-yl)ethyl]-L-leucinamide | C12H22N6O2

N2-Acetyl-N-[2-(5-amino-1H-1,2,4-triazol-3-yl)ethyl]-L-leucinamide

  • Molecular FormulaC12H22N6O2
  • Average mass282.342 Da
  • Monoisotopic mass282.180420 Da
  • ChemSpider ID35069623
  • defined stereocentres - 1 of 1 defined stereocentres


More details:






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

N2-Acetyl-N-[2-(5-amino-1H-1,2,4-triazol-3-yl)ethyl]-L-leucinamid [German] [ACD/IUPAC Name]
N2-Acetyl-N-[2-(5-amino-1H-1,2,4-triazol-3-yl)ethyl]-L-leucinamide [ACD/IUPAC Name]
N2-Acétyl-N-[2-(5-amino-1H-1,2,4-triazol-3-yl)éthyl]-L-leucinamide [French] [ACD/IUPAC Name]
Pentanamide, 2-(acetylamino)-N-[2-(5-amino-1H-1,2,4-triazol-3-yl)ethyl]-4-methyl-, (2S)- [ACD/Index Name]
N2-acetyl-N1-[2-(5-amino-1H-1,2,4-triazol-3-yl)ethyl]-L-leucinamide

Predicted data is generated using the ACD/Labs Percepta Platform - PhysChem Module

Density: 1.2±0.1 g/cm3
Boiling Point:
Vapour Pressure:
Enthalpy of Vaporization:
Flash Point:
Index of Refraction: 1.553
Molar Refractivity: 74.9±0.3 cm3
#H bond acceptors: 8
#H bond donors: 5
#Freely Rotating Bonds: 7
#Rule of 5 Violations: 1
ACD/LogP: -0.69
ACD/LogD (pH 5.5): -0.43
ACD/BCF (pH 5.5): 1.00
ACD/KOC (pH 5.5): 13.21
ACD/LogD (pH 7.4): -0.37
ACD/BCF (pH 7.4): 1.00
ACD/KOC (pH 7.4): 14.89
Polar Surface Area: 126 Å2
Polarizability: 29.7±0.5 10-24cm3
Surface Tension: 54.8±3.0 dyne/cm
Molar Volume: 234.0±3.0 cm3

Click to predict properties on the Chemicalize site






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