ChemSpider 2D Image | N-[(5-Ethyl-1,3,4-thiadiazol-2-yl)methyl]-3,6-dimethyl[1,2]oxazolo[5,4-d]pyrimidin-4-amine | C12H14N6OS

N-[(5-Ethyl-1,3,4-thiadiazol-2-yl)methyl]-3,6-dimethyl[1,2]oxazolo[5,4-d]pyrimidin-4-amine

  • Molecular FormulaC12H14N6OS
  • Average mass290.344 Da
  • Monoisotopic mass290.094971 Da
  • ChemSpider ID29490471

More details:

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

Isoxazolo[5,4-d]pyrimidin-4-amine, N-[(5-ethyl-1,3,4-thiadiazol-2-yl)methyl]-3,6-dimethyl- [ACD/Index Name]
N-[(5-Ethyl-1,3,4-thiadiazol-2-yl)methyl]-3,6-dimethyl[1,2]oxazolo[5,4-d]pyrimidin-4-amin [German] [ACD/IUPAC Name]
N-[(5-Ethyl-1,3,4-thiadiazol-2-yl)methyl]-3,6-dimethyl[1,2]oxazolo[5,4-d]pyrimidin-4-amine [ACD/IUPAC Name]
N-[(5-Éthyl-1,3,4-thiadiazol-2-yl)méthyl]-3,6-diméthyl[1,2]oxazolo[5,4-d]pyrimidin-4-amine [French] [ACD/IUPAC Name]
N-[(5-ethyl-1,3,4-thiadiazol-2-yl)methyl]-3,6-dimethylisoxazolo[5,4-d]pyrimidin-4-amine

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

Density: 1.4±0.1 g/cm3
Boiling Point: 464.6±45.0 °C at 760 mmHg
Vapour Pressure: 0.0±1.1 mmHg at 25°C
Enthalpy of Vaporization: 72.6±3.0 kJ/mol
Flash Point: 234.8±28.7 °C
Index of Refraction: 1.681
Molar Refractivity: 78.5±0.3 cm3
#H bond acceptors: 7
#H bond donors: 1
#Freely Rotating Bonds: 4
#Rule of 5 Violations: 0
ACD/LogP: 0.51
ACD/LogD (pH 5.5): 1.21
ACD/BCF (pH 5.5): 4.86
ACD/KOC (pH 5.5): 106.66
ACD/LogD (pH 7.4): 1.23
ACD/BCF (pH 7.4): 5.05
ACD/KOC (pH 7.4): 110.99
Polar Surface Area: 118 Å2
Polarizability: 31.1±0.5 10-24cm3
Surface Tension: 70.8±3.0 dyne/cm
Molar Volume: 207.5±3.0 cm3

Click to predict properties on the Chemicalize site


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