Found 1 result

Search term: YBLRJHRDYNNITI (Found by InChIKey (skeleton match))
ChemSpider 2D Image | 8-Bromo-N-[(3,5-dimethyl-1H-pyrazol-4-yl)methyl]-4-quinazolinamine | C14H14BrN5

8-Bromo-N-[(3,5-dimethyl-1H-pyrazol-4-yl)methyl]-4-quinazolinamine

  • Molecular FormulaC14H14BrN5
  • Average mass332.198 Da
  • Monoisotopic mass331.043000 Da
  • ChemSpider ID25199925

More details:

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

4-Quinazolinamine, 8-bromo-N-[(3,5-dimethyl-1H-pyrazol-4-yl)methyl]- [ACD/Index Name]
8-Brom-N-[(3,5-dimethyl-1H-pyrazol-4-yl)methyl]-4-chinazolinamin [German] [ACD/IUPAC Name]
8-Bromo-N-[(3,5-dimethyl-1H-pyrazol-4-yl)methyl]-4-quinazolinamine [ACD/IUPAC Name]
8-Bromo-N-[(3,5-diméthyl-1H-pyrazol-4-yl)méthyl]-4-quinazolinamine [French] [ACD/IUPAC Name]

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

Density: 1.6±0.0 g/cm3
Boiling Point: 546.3±0.0 °C at 760 mmHg
Vapour Pressure: 0.0±0.0 mmHg at 25°C
Enthalpy of Vaporization: 82.5±0.0 kJ/mol
Flash Point: 284.2±0.0 °C
Index of Refraction: 1.733
Molar Refractivity: 84.2±0.0 cm3
#H bond acceptors: 5
#H bond donors: 2
#Freely Rotating Bonds: 2
#Rule of 5 Violations: 0
ACD/LogP: 1.62
ACD/LogD (pH 5.5): 1.11
ACD/BCF (pH 5.5): 3.11
ACD/KOC (pH 5.5): 56.19
ACD/LogD (pH 7.4): 1.61
ACD/BCF (pH 7.4): 9.82
ACD/KOC (pH 7.4): 177.10
Polar Surface Area: 66 Å2
Polarizability: 33.4±0.0 10-24cm3
Surface Tension: 70.6±0.0 dyne/cm
Molar Volume: 210.4±0.0 cm3

Click to predict properties on the Chemicalize site


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