ChemSpider 2D Image | 6-{3-[(2-Ethylhexanoyl)amino]phenyl}-8-methyl-N-phenyl-3,4-dihydro-2H,6H-pyrimido[2,1-b][1,3]thiazine-7-carboxamide | C29H36N4O2S

6-{3-[(2-Ethylhexanoyl)amino]phenyl}-8-methyl-N-phenyl-3,4-dihydro-2H,6H-pyrimido[2,1-b][1,3]thiazine-7-carboxamide

  • Molecular FormulaC29H36N4O2S
  • Average mass504.687 Da
  • Monoisotopic mass504.255890 Da
  • ChemSpider ID3645399

More details:

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

2H,6H-Pyrimido[2,1-b][1,3]thiazine-7-carboxamide, 6-[3-[(2-ethyl-1-oxohexyl)amino]phenyl]-3,4-dihydro-8-methyl-N-phenyl- [ACD/Index Name]
6-{3-[(2-Ethylhexanoyl)amino]phenyl}-8-methyl-N-phenyl-3,4-dihydro-2H,6H-pyrimido[2,1-b][1,3]thiazin-7-carboxamid [German] [ACD/IUPAC Name]
6-{3-[(2-Ethylhexanoyl)amino]phenyl}-8-methyl-N-phenyl-3,4-dihydro-2H,6H-pyrimido[2,1-b][1,3]thiazine-7-carboxamide [ACD/IUPAC Name]
6-{3-[(2-Éthylhexanoyl)amino]phényl}-8-méthyl-N-phényl-3,4-dihydro-2H,6H-pyrimido[2,1-b][1,3]thiazine-7-carboxamide [French] [ACD/IUPAC 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:
Vapour Pressure:
Enthalpy of Vaporization:
Flash Point:
Index of Refraction: 1.630
Molar Refractivity: 148.1±0.5 cm3
#H bond acceptors: 6
#H bond donors: 2
#Freely Rotating Bonds: 9
#Rule of 5 Violations: 2
ACD/LogP: 5.75
ACD/LogD (pH 5.5): 4.54
ACD/BCF (pH 5.5): 1116.71
ACD/KOC (pH 5.5): 3308.03
ACD/LogD (pH 7.4): 5.23
ACD/BCF (pH 7.4): 5513.56
ACD/KOC (pH 7.4): 16332.86
Polar Surface Area: 99 Å2
Polarizability: 58.7±0.5 10-24cm3
Surface Tension: 46.5±7.0 dyne/cm
Molar Volume: 416.2±7.0 cm3

Click to predict properties on the Chemicalize site


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