ChemSpider 2D Image | N-(1,3-Benzodioxol-5-ylmethyl)-6-[2,4-dioxo-1-{2-oxo-2-[(tetrahydro-2-furanylmethyl)amino]ethyl}-1,4-dihydrothieno[3,2-d]pyrimidin-3(2H)-yl]hexanamide | C27H32N4O7S

N-(1,3-Benzodioxol-5-ylmethyl)-6-[2,4-dioxo-1-{2-oxo-2-[(tetrahydro-2-furanylmethyl)amino]ethyl}-1,4-dihydrothieno[3,2-d]pyrimidin-3(2H)-yl]hexanamide

  • Molecular FormulaC27H32N4O7S
  • Average mass556.631 Da
  • Monoisotopic mass556.199158 Da
  • ChemSpider ID22496220

More details:

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

N-(1,3-Benzodioxol-5-ylmethyl)-6-[2,4-dioxo-1-{2-oxo-2-[(tetrahydro-2-furanylmethyl)amino]ethyl}-1,4-dihydrothieno[3,2-d]pyrimidin-3(2H)-yl]hexanamid [German] [ACD/IUPAC Name]
N-(1,3-Benzodioxol-5-ylmethyl)-6-[2,4-dioxo-1-{2-oxo-2-[(tetrahydro-2-furanylmethyl)amino]ethyl}-1,4-dihydrothieno[3,2-d]pyrimidin-3(2H)-yl]hexanamide [ACD/IUPAC Name]
N-(1,3-Benzodioxol-5-ylméthyl)-6-[2,4-dioxo-1-{2-oxo-2-[(tétrahydro-2-furanylméthyl)amino]éthyl}-1,4-dihydrothiéno[3,2-d]pyrimidin-3(2H)-yl]hexanamide [French] [ACD/IUPAC Name]
Thieno[3,2-d]pyrimidine-3(2H)-hexanamide, N-(1,3-benzodioxol-5-ylmethyl)-1,4-dihydro-2,4-dioxo-1-[2-oxo-2-[[(tetrahydro-2-furanyl)methyl]amino]ethyl]- [ACD/Index Name]
912884-56-1 [RN]
N-[(2H-1,3-benzodioxol-5-yl)methyl]-6-[2,4-dioxo-1-({[(oxolan-2-yl)methyl]carbamoyl}methyl)-1H,2H,3H,4H-thieno[3,2-d]pyrimidin-3-yl]hexanamide

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

Density: 1.3±0.1 g/cm3
Boiling Point:
Vapour Pressure:
Enthalpy of Vaporization:
Flash Point:
Index of Refraction: 1.601
Molar Refractivity: 142.0±0.3 cm3
#H bond acceptors: 11
#H bond donors: 2
#Freely Rotating Bonds: 12
#Rule of 5 Violations: 2
ACD/LogP: 1.41
ACD/LogD (pH 5.5): 2.00
ACD/BCF (pH 5.5): 19.61
ACD/KOC (pH 5.5): 292.99
ACD/LogD (pH 7.4): 2.00
ACD/BCF (pH 7.4): 19.61
ACD/KOC (pH 7.4): 292.99
Polar Surface Area: 155 Å2
Polarizability: 56.3±0.5 10-24cm3
Surface Tension: 56.9±3.0 dyne/cm
Molar Volume: 414.6±3.0 cm3

Click to predict properties on the Chemicalize site


Advertisement