ChemSpider 2D Image | 3-(Benzyloxy)-5-methyl-N-(4-methyl-1,3-thiazol-2-yl)-2-pyridinamine | C17H17N3OS

3-(Benzyloxy)-5-methyl-N-(4-methyl-1,3-thiazol-2-yl)-2-pyridinamine

  • Molecular FormulaC17H17N3OS
  • Average mass311.401 Da
  • Monoisotopic mass311.109222 Da
  • ChemSpider ID30833132

More details:






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

2-Pyridinamine, 5-methyl-N-(4-methyl-2-thiazolyl)-3-(phenylmethoxy)- [ACD/Index Name]
3-(Benzyloxy)-5-methyl-N-(4-methyl-1,3-thiazol-2-yl)-2-pyridinamin [German] [ACD/IUPAC Name]
3-(Benzyloxy)-5-methyl-N-(4-methyl-1,3-thiazol-2-yl)-2-pyridinamine [ACD/IUPAC Name]
3-(Benzyloxy)-5-méthyl-N-(4-méthyl-1,3-thiazol-2-yl)-2-pyridinamine [French] [ACD/IUPAC Name]
3-(Benzyloxy)-5-Methyl-N-(4-Methyl-1,3-Thiazol-2-Yl)pyridin-2-Amine
10.1021/jm401116k
VO2

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

Density: 1.3±0.1 g/cm3
Boiling Point: 494.4±55.0 °C at 760 mmHg
Vapour Pressure: 0.0±1.3 mmHg at 25°C
Enthalpy of Vaporization: 76.2±3.0 kJ/mol
Flash Point: 252.8±31.5 °C
Index of Refraction: 1.653
Molar Refractivity: 91.0±0.3 cm3
#H bond acceptors: 4
#H bond donors: 1
#Freely Rotating Bonds: 5
#Rule of 5 Violations: 0
ACD/LogP: 3.88
ACD/LogD (pH 5.5): 4.61
ACD/BCF (pH 5.5): 1832.62
ACD/KOC (pH 5.5): 7303.94
ACD/LogD (pH 7.4): 4.66
ACD/BCF (pH 7.4): 2045.51
ACD/KOC (pH 7.4): 8152.40
Polar Surface Area: 75 Å2
Polarizability: 36.1±0.5 10-24cm3
Surface Tension: 54.7±3.0 dyne/cm
Molar Volume: 248.7±3.0 cm3

Click to predict properties on the Chemicalize site






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