ChemSpider 2D Image | [3-(Hydroxymethyl)-1-piperidinyl](4-{4-[(3-phenylpropyl)amino]-1-piperidinyl}phenyl)methanone | C27H37N3O2

[3-(Hydroxymethyl)-1-piperidinyl](4-{4-[(3-phenylpropyl)amino]-1-piperidinyl}phenyl)methanone

  • Molecular FormulaC27H37N3O2
  • Average mass435.602 Da
  • Monoisotopic mass435.288574 Da
  • ChemSpider ID22221140

More details:

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

[3-(Hydroxymethyl)-1-piperidinyl](4-{4-[(3-phenylpropyl)amino]-1-piperidinyl}phenyl)methanon [German] [ACD/IUPAC Name]
[3-(Hydroxymethyl)-1-piperidinyl](4-{4-[(3-phenylpropyl)amino]-1-piperidinyl}phenyl)methanone [ACD/IUPAC Name]
[3-(Hydroxyméthyl)-1-pipéridinyl](4-{4-[(3-phénylpropyl)amino]-1-pipéridinyl}phényl)méthanone [French] [ACD/IUPAC Name]
Methanone, [3-(hydroxymethyl)-1-piperidinyl][4-[4-[(3-phenylpropyl)amino]-1-piperidinyl]phenyl]- [ACD/Index Name]
[1-(4-{4-[(3-phenylpropyl)amino]-1-piperidinyl}benzoyl)-3-piperidinyl]methanol
[1-(4-{4-[(3-PHENYLPROPYL)AMINO]PIPERIDIN-1-YL}BENZOYL)PIPERIDIN-3-YL]METHANOL

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

Density: 1.2±0.1 g/cm3
Boiling Point: 644.1±55.0 °C at 760 mmHg
Vapour Pressure: 0.0±2.0 mmHg at 25°C
Enthalpy of Vaporization: 99.9±3.0 kJ/mol
Flash Point: 343.3±31.5 °C
Index of Refraction: 1.615
Molar Refractivity: 129.9±0.4 cm3
#H bond acceptors: 5
#H bond donors: 2
#Freely Rotating Bonds: 8
#Rule of 5 Violations: 0
ACD/LogP: 1.67
ACD/LogD (pH 5.5): -0.18
ACD/BCF (pH 5.5): 1.00
ACD/KOC (pH 5.5): 1.00
ACD/LogD (pH 7.4): 0.40
ACD/BCF (pH 7.4): 1.00
ACD/KOC (pH 7.4): 2.85
Polar Surface Area: 56 Å2
Polarizability: 51.5±0.5 10-24cm3
Surface Tension: 55.8±5.0 dyne/cm
Molar Volume: 372.0±5.0 cm3

Click to predict properties on the Chemicalize site


Advertisement