Found 1 result

Search term: SPZPZNOBTYSYGU (Found by InChIKey (skeleton match))
ChemSpider 2D Image | 4-Ethyl-5-(1-{[(2-methoxyethyl)(methyl)amino]acetyl}-3-piperidinyl)-2-methyl-2,4-dihydro-3H-1,2,4-triazol-3-one | C16H29N5O3

4-Ethyl-5-(1-{[(2-methoxyethyl)(methyl)amino]acetyl}-3-piperidinyl)-2-methyl-2,4-dihydro-3H-1,2,4-triazol-3-one

  • Molecular FormulaC16H29N5O3
  • Average mass339.433 Da
  • Monoisotopic mass339.227051 Da
  • ChemSpider ID29583046

More details:

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

3H-1,2,4-Triazol-3-one, 4-ethyl-2,4-dihydro-5-[1-[2-[(2-methoxyethyl)methylamino]acetyl]-3-piperidinyl]-2-methyl- [ACD/Index Name]
4-Ethyl-5-(1-{[(2-methoxyethyl)(methyl)amino]acetyl}-3-piperidinyl)-2-methyl-2,4-dihydro-3H-1,2,4-triazol-3-on [German] [ACD/IUPAC Name]
4-Ethyl-5-(1-{[(2-methoxyethyl)(methyl)amino]acetyl}-3-piperidinyl)-2-methyl-2,4-dihydro-3H-1,2,4-triazol-3-one [ACD/IUPAC Name]
4-Éthyl-5-(1-{2-[(2-méthoxyéthyl)(méthyl)amino]acétyl}-3-pipéridinyl)-2-méthyl-2,4-dihydro-3H-1,2,4-triazol-3-one [French] [ACD/IUPAC Name]
4-ethyl-5-(1-{[(2-methoxyethyl)(methyl)amino]acetyl}piperidin-3-yl)-2-methyl-2,4-dihydro-3H-1,2,4-triazol-3-one

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

Density: 1.2±0.1 g/cm3
Boiling Point: 462.9±55.0 °C at 760 mmHg
Vapour Pressure: 0.0±1.1 mmHg at 25°C
Enthalpy of Vaporization: 72.4±3.0 kJ/mol
Flash Point: 233.8±31.5 °C
Index of Refraction: 1.578
Molar Refractivity: 92.4±0.5 cm3
#H bond acceptors: 8
#H bond donors: 0
#Freely Rotating Bonds: 7
#Rule of 5 Violations: 0
ACD/LogP: -1.97
ACD/LogD (pH 5.5): -2.86
ACD/BCF (pH 5.5): 1.00
ACD/KOC (pH 5.5): 1.00
ACD/LogD (pH 7.4): -0.92
ACD/BCF (pH 7.4): 1.00
ACD/KOC (pH 7.4): 5.42
Polar Surface Area: 69 Å2
Polarizability: 36.6±0.5 10-24cm3
Surface Tension: 44.4±7.0 dyne/cm
Molar Volume: 278.6±7.0 cm3

Click to predict properties on the Chemicalize site


Advertisement