ChemSpider 2D Image | 4-[2-(Difluoromethyl)-1H-benzimidazol-1-yl]-N-{2-methyl-1-[2-(1-methyl-4-piperidinyl)phenyl]-2-propanyl}-6-(4-morpholinyl)-1,3,5-triazin-2-amine | C31H38F2N8O

4-[2-(Difluoromethyl)-1H-benzimidazol-1-yl]-N-{2-methyl-1-[2-(1-methyl-4-piperidinyl)phenyl]-2-propanyl}-6-(4-morpholinyl)-1,3,5-triazin-2-amine

  • Molecular FormulaC31H38F2N8O
  • Average mass576.683 Da
  • Monoisotopic mass576.313660 Da
  • ChemSpider ID57617733

More details:






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

1,3,5-Triazin-2-amine, 4-[2-(difluoromethyl)-1H-benzimidazol-1-yl]-N-[1,1-dimethyl-2-[2-(1-methyl-4-piperidinyl)phenyl]ethyl]-6-(4-morpholinyl)- [ACD/Index Name]
1401436-95-0 [RN]
4-[2-(Difluormethyl)-1H-benzimidazol-1-yl]-N-{2-methyl-1-[2-(1-methyl-4-piperidinyl)phenyl]-2-propanyl}-6-(4-morpholinyl)-1,3,5-triazin-2-amin [German] [ACD/IUPAC Name]
4-[2-(difluoromethyl)-1H-1,3-benzodiazol-1-yl]-N-{2-methyl-1-[2-(1-methylpiperidin-4-yl)phenyl]propan-2-yl}-6-(morpholin-4-yl)-1,3,5-triazin-2-amine
4-[2-(Difluoromethyl)-1H-benzimidazol-1-yl]-N-{2-methyl-1-[2-(1-methyl-4-piperidinyl)phenyl]-2-propanyl}-6-(4-morpholinyl)-1,3,5-triazin-2-amine [ACD/IUPAC Name]
4-[2-(Difluorométhyl)-1H-benzimidazol-1-yl]-N-{2-méthyl-1-[2-(1-méthyl-4-pipéridinyl)phényl]-2-propanyl}-6-(4-morpholinyl)-1,3,5-triazin-2-amine [French] [ACD/IUPAC Name]
4-(2-(difluoromethyl)-1H-benzo[d]imidazol-1-yl)-N-(2-methyl-1-(2-(1-methylpiperidin-4-yl)phenyl)propan-2-yl)-6-morpholino-1,3,5-triazin-2-amine
Zandelisib

Predicted data is generated using the ACD/Labs Percepta Platform - PhysChem Module

Density: 1.3±0.1 g/cm3
Boiling Point: 729.2±70.0 °C at 760 mmHg
Vapour Pressure: 0.0±2.4 mmHg at 25°C
Enthalpy of Vaporization: 106.4±3.0 kJ/mol
Flash Point: 394.8±35.7 °C
Index of Refraction: 1.657
Molar Refractivity: 158.4±0.5 cm3
#H bond acceptors: 9
#H bond donors: 1
#Freely Rotating Bonds: 8
#Rule of 5 Violations: 1
ACD/LogP: 3.68
ACD/LogD (pH 5.5): 1.19
ACD/BCF (pH 5.5): 1.00
ACD/KOC (pH 5.5): 4.59
ACD/LogD (pH 7.4): 2.62
ACD/BCF (pH 7.4): 24.29
ACD/KOC (pH 7.4): 123.11
Polar Surface Area: 84 Å2
Polarizability: 62.8±0.5 10-24cm3
Surface Tension: 48.4±7.0 dyne/cm
Molar Volume: 430.6±7.0 cm3

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