ChemSpider 2D Image | 5-[3-(4-Cyclopropyl-2-pyrimidinyl)-1H-indol-5-yl]-N-(2-methyl-2-propanyl)-1,3,4-oxadiazol-2-amine | C21H22N6O

5-[3-(4-Cyclopropyl-2-pyrimidinyl)-1H-indol-5-yl]-N-(2-methyl-2-propanyl)-1,3,4-oxadiazol-2-amine

  • Molecular FormulaC21H22N6O
  • Average mass374.439 Da
  • Monoisotopic mass374.185516 Da
  • ChemSpider ID32033480

More details:






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

1,3,4-Oxadiazol-2-amine, 5-[3-(4-cyclopropyl-2-pyrimidinyl)-1H-indol-5-yl]-N-(1,1-dimethylethyl)- [ACD/Index Name]
5-[3-(4-Cyclopropyl-2-pyrimidinyl)-1H-indol-5-yl]-N-(2-methyl-2-propanyl)-1,3,4-oxadiazol-2-amin [German] [ACD/IUPAC Name]
5-[3-(4-Cyclopropyl-2-pyrimidinyl)-1H-indol-5-yl]-N-(2-methyl-2-propanyl)-1,3,4-oxadiazol-2-amine [ACD/IUPAC Name]
5-[3-(4-Cyclopropyl-2-pyrimidinyl)-1H-indol-5-yl]-N-(2-méthyl-2-propanyl)-1,3,4-oxadiazol-2-amine [French] [ACD/IUPAC Name]
38W
N-Tert-Butyl-5-[3-(4-Cyclopropylpyrimidin-2-Yl)-1h-Indol-5-Yl]-1,3,4-Oxadiazol-2-Amine

Predicted data is generated using the ACD/Labs Percepta Platform - PhysChem Module

Density: 1.3±0.1 g/cm3
Boiling Point: 535.7±60.0 °C at 760 mmHg
Vapour Pressure: 0.0±1.4 mmHg at 25°C
Enthalpy of Vaporization: 81.2±3.0 kJ/mol
Flash Point: 277.8±32.9 °C
Index of Refraction: 1.681
Molar Refractivity: 107.9±0.3 cm3
#H bond acceptors: 7
#H bond donors: 2
#Freely Rotating Bonds: 5
#Rule of 5 Violations: 0
ACD/LogP: 4.08
ACD/LogD (pH 5.5): 4.05
ACD/BCF (pH 5.5): 701.16
ACD/KOC (pH 5.5): 3789.46
ACD/LogD (pH 7.4): 4.05
ACD/BCF (pH 7.4): 701.50
ACD/KOC (pH 7.4): 3791.31
Polar Surface Area: 93 Å2
Polarizability: 42.8±0.5 10-24cm3
Surface Tension: 64.3±3.0 dyne/cm
Molar Volume: 285.1±3.0 cm3

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