ChemSpider 2D Image | 5-{[1-(2-Fluorobenzyl)-4-piperidinyl]methoxy}-2,4-quinazolinediamine | C21H24FN5O

5-{[1-(2-Fluorobenzyl)-4-piperidinyl]methoxy}-2,4-quinazolinediamine

  • Molecular FormulaC21H24FN5O
  • Average mass381.447 Da
  • Monoisotopic mass381.196503 Da
  • ChemSpider ID23311147

More details:

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

2,4-Quinazolinediamine, 5-[[1-[(2-fluorophenyl)methyl]-4-piperidinyl]methoxy]- [ACD/Index Name]
5-{[1-(2-Fluorbenzyl)-4-piperidinyl]methoxy}-2,4-chinazolindiamin [German] [ACD/IUPAC Name]
5-{[1-(2-Fluorobenzyl)-4-piperidinyl]methoxy}-2,4-quinazolinediamine [ACD/IUPAC Name]
5-{[1-(2-Fluorobenzyl)-4-pipéridinyl]méthoxy}-2,4-quinazolinediamine [French] [ACD/IUPAC Name]
5-{[1-(2-fluorobenzyl)piperidin-4-yl]methoxy}quinazoline-2,4-diamine
5-((1-(2-fluorobenzyl)piperidin-4-yl)methoxy)quinazoline-2,4-diamine
5-({1-[(2-fluorophenyl)methyl]piperidin-4-yl}methoxy)quinazoline-2,4-diamine
CHEMBL251429
DD1

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

Density: 1.3±0.1 g/cm3
Boiling Point: 607.9±65.0 °C at 760 mmHg
Vapour Pressure: 0.0±1.7 mmHg at 25°C
Enthalpy of Vaporization: 90.3±3.0 kJ/mol
Flash Point: 321.5±34.3 °C
Index of Refraction: 1.664
Molar Refractivity: 109.2±0.3 cm3
#H bond acceptors: 6
#H bond donors: 4
#Freely Rotating Bonds: 5
#Rule of 5 Violations: 0
ACD/LogP: 3.10
ACD/LogD (pH 5.5): -0.82
ACD/BCF (pH 5.5): 1.00
ACD/KOC (pH 5.5): 1.00
ACD/LogD (pH 7.4): 1.87
ACD/BCF (pH 7.4): 7.82
ACD/KOC (pH 7.4): 67.67
Polar Surface Area: 90 Å2
Polarizability: 43.3±0.5 10-24cm3
Surface Tension: 63.7±3.0 dyne/cm
Molar Volume: 294.6±3.0 cm3

Click to predict properties on the Chemicalize site


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