ChemSpider 2D Image | 1-[3-(2-{[4-(Cyclopropylmethyl)-1-piperazinyl]methyl}-4-methoxyphenoxy)-2-hydroxypropyl]-4-piperidinol | C24H39N3O4

1-[3-(2-{[4-(Cyclopropylmethyl)-1-piperazinyl]methyl}-4-methoxyphenoxy)-2-hydroxypropyl]-4-piperidinol

  • Molecular FormulaC24H39N3O4
  • Average mass433.584 Da
  • Monoisotopic mass433.294067 Da
  • ChemSpider ID22121336

More details:

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

1-[3-(2-{[4-(Cyclopropylmethyl)-1-piperazinyl]methyl}-4-methoxyphenoxy)-2-hydroxypropyl]-4-piperidinol [ACD/IUPAC Name]
1-[3-(2-{[4-(Cyclopropylmethyl)-1-piperazinyl]methyl}-4-methoxyphenoxy)-2-hydroxypropyl]-4-piperidinol [German] [ACD/IUPAC Name]
1-[3-(2-{[4-(Cyclopropylméthyl)-1-pipérazinyl]méthyl}-4-méthoxyphénoxy)-2-hydroxypropyl]-4-pipéridinol [French] [ACD/IUPAC Name]
1-Piperidineethanol, α-[[2-[[4-(cyclopropylmethyl)-1-piperazinyl]methyl]-4-methoxyphenoxy]methyl]-4-hydroxy- [ACD/Index 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: 603.7±55.0 °C at 760 mmHg
Vapour Pressure: 0.0±1.8 mmHg at 25°C
Enthalpy of Vaporization: 94.4±3.0 kJ/mol
Flash Point: 318.9±31.5 °C
Index of Refraction: 1.584
Molar Refractivity: 121.6±0.3 cm3
#H bond acceptors: 7
#H bond donors: 2
#Freely Rotating Bonds: 10
#Rule of 5 Violations: 0
ACD/LogP: 0.81
ACD/LogD (pH 5.5): -2.91
ACD/BCF (pH 5.5): 1.00
ACD/KOC (pH 5.5): 1.00
ACD/LogD (pH 7.4): -0.24
ACD/BCF (pH 7.4): 1.00
ACD/KOC (pH 7.4): 4.32
Polar Surface Area: 69 Å2
Polarizability: 48.2±0.5 10-24cm3
Surface Tension: 53.1±3.0 dyne/cm
Molar Volume: 363.2±3.0 cm3

Click to predict properties on the Chemicalize site


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