ChemSpider 2D Image | 4-[(3-Methoxypropyl)amino]-5-methyl-N-[2-(methylsulfanyl)ethyl]thieno[2,3-d]pyrimidine-6-carboxamide | C15H22N4O2S2

4-[(3-Methoxypropyl)amino]-5-methyl-N-[2-(methylsulfanyl)ethyl]thieno[2,3-d]pyrimidine-6-carboxamide

  • Molecular FormulaC15H22N4O2S2
  • Average mass354.491 Da
  • Monoisotopic mass354.118408 Da
  • ChemSpider ID23047594

More details:

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

4-[(3-Methoxypropyl)amino]-5-methyl-N-[2-(methylsulfanyl)ethyl]thieno[2,3-d]pyrimidin-6-carboxamid [German] [ACD/IUPAC Name]
4-[(3-Methoxypropyl)amino]-5-methyl-N-[2-(methylsulfanyl)ethyl]thieno[2,3-d]pyrimidine-6-carboxamide [ACD/IUPAC Name]
4-[(3-Méthoxypropyl)amino]-5-méthyl-N-[2-(méthylsulfanyl)éthyl]thiéno[2,3-d]pyrimidine-6-carboxamide [French] [ACD/IUPAC Name]
Thieno[2,3-d]pyrimidine-6-carboxamide, 4-[(3-methoxypropyl)amino]-5-methyl-N-[2-(methylthio)ethyl]- [ACD/Index Name]
4-[(3-methoxypropyl)amino]-5-methyl-N-[2-(methylthio)ethyl]thieno[2,3-d]pyrimidine-6-carboxamide

Predicted data is generated using the ACD/Labs Percepta Platform - PhysChem Module, version: 14.00

Density: 1.3±0.1 g/cm3
Boiling Point: 596.2±50.0 °C at 760 mmHg
Vapour Pressure: 0.0±1.7 mmHg at 25°C
Enthalpy of Vaporization: 88.8±3.0 kJ/mol
Flash Point: 314.4±30.1 °C
Index of Refraction: 1.635
Molar Refractivity: 99.6±0.3 cm3
#H bond acceptors: 6
#H bond donors: 2
#Freely Rotating Bonds: 9
#Rule of 5 Violations: 0
ACD/LogP: 1.90
ACD/LogD (pH 5.5): 2.22
ACD/BCF (pH 5.5): 27.39
ACD/KOC (pH 5.5): 349.98
ACD/LogD (pH 7.4): 2.32
ACD/BCF (pH 7.4): 33.88
ACD/KOC (pH 7.4): 432.91
Polar Surface Area: 130 Å2
Polarizability: 39.5±0.5 10-24cm3
Surface Tension: 56.0±3.0 dyne/cm
Molar Volume: 278.4±3.0 cm3

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