Found 106 results

Search term: MF = 'C_{21}H_{28}N_{8}O_{2}S'
ChemSpider 2D Image | N-[(2,4-Diamino-6-methyl-5,6-dihydrofuro[2,3-d]pyrimidin-6-yl)methyl]-N~3~-(5,6-dimethylthieno[2,3-d]pyrimidin-4-yl)-N-ethyl-beta-alaninamide | C21H28N8O2S

N-[(2,4-Diamino-6-methyl-5,6-dihydrofuro[2,3-d]pyrimidin-6-yl)methyl]-N3-(5,6-dimethylthieno[2,3-d]pyrimidin-4-yl)-N-ethyl-β-alaninamide

  • Molecular FormulaC21H28N8O2S
  • Average mass456.564 Da
  • Monoisotopic mass456.205597 Da
  • ChemSpider ID68639175

More details:

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

N-[(2,4-Diamino-6-methyl-5,6-dihydrofuro[2,3-d]pyrimidin-6-yl)methyl]-N3-(5,6-dimethylthieno[2,3-d]pyrimidin-4-yl)-N-ethyl-β-alaninamid [German] [ACD/IUPAC Name]
N-[(2,4-Diamino-6-methyl-5,6-dihydrofuro[2,3-d]pyrimidin-6-yl)methyl]-N3-(5,6-dimethylthieno[2,3-d]pyrimidin-4-yl)-N-ethyl-β-alaninamide [ACD/IUPAC Name]
N-[(2,4-Diamino-6-méthyl-5,6-dihydrofuro[2,3-d]pyrimidin-6-yl)méthyl]-N3-(5,6-diméthylthiéno[2,3-d]pyrimidin-4-yl)-N-éthyl-β-alaninamide [French] [ACD/IUPAC Name]
Propanamide, N-[(2,4-diamino-5,6-dihydro-6-methylfuro[2,3-d]pyrimidin-6-yl)methyl]-3-[(5,6-dimethylthieno[2,3-d]pyrimidin-4-yl)amino]-N-ethyl- [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: 771.7±70.0 °C at 760 mmHg
Vapour Pressure: 0.0±2.6 mmHg at 25°C
Enthalpy of Vaporization: 112.3±3.0 kJ/mol
Flash Point: 420.5±35.7 °C
Index of Refraction: 1.691
Molar Refractivity: 127.5±0.3 cm3
#H bond acceptors: 10
#H bond donors: 5
#Freely Rotating Bonds: 7
#Rule of 5 Violations: 2
ACD/LogP: 2.78
ACD/LogD (pH 5.5): 1.89
ACD/BCF (pH 5.5): 11.47
ACD/KOC (pH 5.5): 133.97
ACD/LogD (pH 7.4): 2.49
ACD/BCF (pH 7.4): 45.36
ACD/KOC (pH 7.4): 529.86
Polar Surface Area: 173 Å2
Polarizability: 50.6±0.5 10-24cm3
Surface Tension: 74.8±3.0 dyne/cm
Molar Volume: 333.4±3.0 cm3

Click to predict properties on the Chemicalize site


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