ChemSpider 2D Image | tepotinib | C29H28N6O2

tepotinib

  • Molecular FormulaC29H28N6O2
  • Average mass492.572 Da
  • Monoisotopic mass492.227386 Da
  • ChemSpider ID28637823

More details:






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

3-[1-(3-{5-[(1-Methyl-4-piperidinyl)methoxy]-2-pyrimidinyl}benzyl)-6-oxo-1,6-dihydro-3-pyridazinyl]benzonitril [German] [ACD/IUPAC Name]
3-[1-(3-{5-[(1-Methyl-4-piperidinyl)methoxy]-2-pyrimidinyl}benzyl)-6-oxo-1,6-dihydro-3-pyridazinyl]benzonitrile [ACD/IUPAC Name]
3-[1-(3-{5-[(1-Méthyl-4-pipéridinyl)méthoxy]-2-pyrimidinyl}benzyl)-6-oxo-1,6-dihydro-3-pyridazinyl]benzonitrile [French] [ACD/IUPAC Name]
Benzonitrile, 3-[1,6-dihydro-1-[[3-[5-[(1-methyl-4-piperidinyl)methoxy]-2-pyrimidinyl]phenyl]methyl]-6-oxo-3-pyridazinyl]- [ACD/Index Name]
tepotinib [INN]
tepotinib [Spanish] [INN]
tépotinib [French] [INN]
tepotinibum [Latin] [INN]
тепотиниб [Russian] [INN]
تيبوتينيب [Arabic] [INN]
More...

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

Density: 1.3±0.1 g/cm3
Boiling Point: 626.5±65.0 °C at 760 mmHg
Vapour Pressure: 0.0±1.8 mmHg at 25°C
Enthalpy of Vaporization: 92.7±3.0 kJ/mol
Flash Point: 332.7±34.3 °C
Index of Refraction: 1.660
Molar Refractivity: 144.5±0.5 cm3
#H bond acceptors: 8
#H bond donors: 0
#Freely Rotating Bonds: 8
#Rule of 5 Violations: 0
ACD/LogP: 2.72
ACD/LogD (pH 5.5): 0.28
ACD/BCF (pH 5.5): 1.00
ACD/KOC (pH 5.5): 1.58
ACD/LogD (pH 7.4): 1.71
ACD/BCF (pH 7.4): 5.12
ACD/KOC (pH 7.4): 42.09
Polar Surface Area: 95 Å2
Polarizability: 57.3±0.5 10-24cm3
Surface Tension: 52.1±7.0 dyne/cm
Molar Volume: 391.6±7.0 cm3

Click to predict properties on the Chemicalize site






Advertisement