ChemSpider 2D Image | 2,6-Dimethyl-4-[4-({4-[3-(3-pyridinyl)-1H-1,2,4-triazol-5-yl]-1-piperidinyl}methyl)-2-pyrimidinyl]morpholine | C23H30N8O

2,6-Dimethyl-4-[4-({4-[3-(3-pyridinyl)-1H-1,2,4-triazol-5-yl]-1-piperidinyl}methyl)-2-pyrimidinyl]morpholine

  • Molecular FormulaC23H30N8O
  • Average mass434.537 Da
  • Monoisotopic mass434.254272 Da
  • ChemSpider ID24983068

More details:

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

2,6-Dimethyl-4-[4-({4-[3-(3-pyridinyl)-1H-1,2,4-triazol-5-yl]-1-piperidinyl}methyl)-2-pyrimidinyl]morpholin [German] [ACD/IUPAC Name]
2,6-Dimethyl-4-[4-({4-[3-(3-pyridinyl)-1H-1,2,4-triazol-5-yl]-1-piperidinyl}methyl)-2-pyrimidinyl]morpholine [ACD/IUPAC Name]
2,6-Diméthyl-4-[4-({4-[3-(3-pyridinyl)-1H-1,2,4-triazol-5-yl]-1-pipéridinyl}méthyl)-2-pyrimidinyl]morpholine [French] [ACD/IUPAC Name]
Morpholine, 2,6-dimethyl-4-[4-[[4-[3-(3-pyridinyl)-1H-1,2,4-triazol-5-yl]-1-piperidinyl]methyl]-2-pyrimidinyl]- [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: 678.2±65.0 °C at 760 mmHg
Vapour Pressure: 0.0±2.1 mmHg at 25°C
Enthalpy of Vaporization: 99.6±3.0 kJ/mol
Flash Point: 364.0±34.3 °C
Index of Refraction: 1.601
Molar Refractivity: 120.9±0.3 cm3
#H bond acceptors: 9
#H bond donors: 1
#Freely Rotating Bonds: 5
#Rule of 5 Violations: 0
ACD/LogP: 1.96
ACD/LogD (pH 5.5): 1.47
ACD/BCF (pH 5.5): 5.56
ACD/KOC (pH 5.5): 79.93
ACD/LogD (pH 7.4): 2.06
ACD/BCF (pH 7.4): 21.30
ACD/KOC (pH 7.4): 306.06
Polar Surface Area: 96 Å2
Polarizability: 47.9±0.5 10-24cm3
Surface Tension: 58.3±3.0 dyne/cm
Molar Volume: 353.0±3.0 cm3

Click to predict properties on the Chemicalize site


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