ChemSpider 2D Image | (4-Methyl-1-piperazinyl)[4-{4-(4-morpholinyl)-6-[(3,4,5-trimethoxyphenyl)amino]-1,3,5-triazin-2-yl}-3,6-dihydro-1(2H)-pyridinyl]methanone | C27H38N8O5

(4-Methyl-1-piperazinyl)[4-{4-(4-morpholinyl)-6-[(3,4,5-trimethoxyphenyl)amino]-1,3,5-triazin-2-yl}-3,6-dihydro-1(2H)-pyridinyl]methanone

  • Molecular FormulaC27H38N8O5
  • Average mass554.641 Da
  • Monoisotopic mass554.296509 Da
  • ChemSpider ID76754214

More details:

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

(4-Methyl-1-piperazinyl)[4-{4-(4-morpholinyl)-6-[(3,4,5-trimethoxyphenyl)amino]-1,3,5-triazin-2-yl}-3,6-dihydro-1(2H)-pyridinyl]methanon [German] [ACD/IUPAC Name]
(4-Methyl-1-piperazinyl)[4-{4-(4-morpholinyl)-6-[(3,4,5-trimethoxyphenyl)amino]-1,3,5-triazin-2-yl}-3,6-dihydro-1(2H)-pyridinyl]methanone [ACD/IUPAC Name]
(4-Méthyl-1-pipérazinyl)[4-{4-(4-morpholinyl)-6-[(3,4,5-triméthoxyphényl)amino]-1,3,5-triazin-2-yl}-3,6-dihydro-1(2H)-pyridinyl]méthanone [French] [ACD/IUPAC Name]
Methanone, [3,6-dihydro-4-[4-(4-morpholinyl)-6-[(3,4,5-trimethoxyphenyl)amino]-1,3,5-triazin-2-yl]-1(2H)-pyridinyl](4-methyl-1-piperazinyl)- [ACD/Index Name]

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

Density: 1.3±0.1 g/cm3
Boiling Point: 725.5±70.0 °C at 760 mmHg
Vapour Pressure: 0.0±2.4 mmHg at 25°C
Enthalpy of Vaporization: 105.9±3.0 kJ/mol
Flash Point: 392.6±35.7 °C
Index of Refraction: 1.610
Molar Refractivity: 149.0±0.3 cm3
#H bond acceptors: 13
#H bond donors: 1
#Freely Rotating Bonds: 7
#Rule of 5 Violations: 2
ACD/LogP: 0.51
ACD/LogD (pH 5.5): -0.53
ACD/BCF (pH 5.5): 1.00
ACD/KOC (pH 5.5): 1.88
ACD/LogD (pH 7.4): 1.05
ACD/BCF (pH 7.4): 3.29
ACD/KOC (pH 7.4): 71.01
Polar Surface Area: 118 Å2
Polarizability: 59.1±0.5 10-24cm3
Surface Tension: 59.1±3.0 dyne/cm
Molar Volume: 429.9±3.0 cm3

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