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Search term: VPPAJVRIQGSDAB-UHFFFAOYSA-N (Found by InChIKey (full match))
ChemSpider 2D Image | N-(1,3-Benzodioxol-5-ylmethyl)-2,5,6-trimethylthieno[2,3-d]pyrimidin-4-amine | C17H17N3O2S

N-(1,3-Benzodioxol-5-ylmethyl)-2,5,6-trimethylthieno[2,3-d]pyrimidin-4-amine

  • Molecular FormulaC17H17N3O2S
  • Average mass327.401 Da
  • Monoisotopic mass327.104156 Da
  • ChemSpider ID69419266

More details:

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

N-(1,3-Benzodioxol-5-ylmethyl)-2,5,6-trimethylthieno[2,3-d]pyrimidin-4-amin [German] [ACD/IUPAC Name]
N-(1,3-Benzodioxol-5-ylmethyl)-2,5,6-trimethylthieno[2,3-d]pyrimidin-4-amine [ACD/IUPAC Name]
N-(1,3-Benzodioxol-5-ylméthyl)-2,5,6-triméthylthiéno[2,3-d]pyrimidin-4-amine [French] [ACD/IUPAC Name]
Thieno[2,3-d]pyrimidin-4-amine, N-(1,3-benzodioxol-5-ylmethyl)-2,5,6-trimethyl- [ACD/Index Name]

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

Density: 1.4±0.1 g/cm3
Boiling Point:
Vapour Pressure:
Enthalpy of Vaporization:
Flash Point:
Index of Refraction: 1.708
Molar Refractivity: 93.4±0.3 cm3
#H bond acceptors: 5
#H bond donors: 1
#Freely Rotating Bonds: 3
#Rule of 5 Violations: 1
ACD/LogP: 5.07
ACD/LogD (pH 5.5): 3.46
ACD/BCF (pH 5.5): 170.91
ACD/KOC (pH 5.5): 866.44
ACD/LogD (pH 7.4): 4.15
ACD/BCF (pH 7.4): 834.62
ACD/KOC (pH 7.4): 4231.06
Polar Surface Area: 85 Å2
Polarizability: 37.0±0.5 10-24cm3
Surface Tension: 65.6±3.0 dyne/cm
Molar Volume: 239.6±3.0 cm3

Click to predict properties on the Chemicalize site


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