ChemSpider 2D Image | 2-[3-(3-Methylphenyl)-1,2,4-oxadiazol-5-yl]-5,6,7,8-tetrahydroimidazo[4,5-c]azepin-4(1H)-one | C16H15N5O2

2-[3-(3-Methylphenyl)-1,2,4-oxadiazol-5-yl]-5,6,7,8-tetrahydroimidazo[4,5-c]azepin-4(1H)-one

  • Molecular FormulaC16H15N5O2
  • Average mass309.323 Da
  • Monoisotopic mass309.122589 Da
  • ChemSpider ID29568365

More details:

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

2-[3-(3-Methylphenyl)-1,2,4-oxadiazol-5-yl]-5,6,7,8-tetrahydroimidazo[4,5-c]azepin-4(1H)-on [German] [ACD/IUPAC Name]
2-[3-(3-Methylphenyl)-1,2,4-oxadiazol-5-yl]-5,6,7,8-tetrahydroimidazo[4,5-c]azepin-4(1H)-one [ACD/IUPAC Name]
2-[3-(3-Méthylphényl)-1,2,4-oxadiazol-5-yl]-5,6,7,8-tétrahydroimidazo[4,5-c]azépin-4(1H)-one [French] [ACD/IUPAC Name]
Imidazo[4,5-c]azepin-4(1H)-one, 5,6,7,8-tetrahydro-2-[3-(3-methylphenyl)-1,2,4-oxadiazol-5-yl]- [ACD/Index Name]

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

Density: 1.3±0.1 g/cm3
Boiling Point:
Vapour Pressure:
Enthalpy of Vaporization:
Flash Point:
Index of Refraction: 1.613
Molar Refractivity: 81.5±0.3 cm3
#H bond acceptors: 7
#H bond donors: 2
#Freely Rotating Bonds: 2
#Rule of 5 Violations: 0
ACD/LogP: 3.10
ACD/LogD (pH 5.5): 2.06
ACD/BCF (pH 5.5): 21.49
ACD/KOC (pH 5.5): 311.88
ACD/LogD (pH 7.4): 1.81
ACD/BCF (pH 7.4): 12.06
ACD/KOC (pH 7.4): 175.07
Polar Surface Area: 97 Å2
Polarizability: 32.3±0.5 10-24cm3
Surface Tension: 60.0±3.0 dyne/cm
Molar Volume: 234.2±3.0 cm3

Click to predict properties on the Chemicalize site


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