ChemSpider 2D Image | (4-{5-[(8-Methyl-2,4-dioxo-1,3-diazaspiro[4.5]dec-3-yl)methyl]-1,2,4-oxadiazol-3-yl}phenyl)boronic acid | C18H21BN4O5

(4-{5-[(8-Methyl-2,4-dioxo-1,3-diazaspiro[4.5]dec-3-yl)methyl]-1,2,4-oxadiazol-3-yl}phenyl)boronic acid

  • Molecular FormulaC18H21BN4O5
  • Average mass384.194 Da
  • Monoisotopic mass384.160492 Da
  • ChemSpider ID72942961

More details:

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

(4-{5-[(8-Methyl-2,4-dioxo-1,3-diazaspiro[4.5]dec-3-yl)methyl]-1,2,4-oxadiazol-3-yl}phenyl)boronic acid [ACD/IUPAC Name]
(4-{5-[(8-Methyl-2,4-dioxo-1,3-diazaspiro[4.5]dec-3-yl)methyl]-1,2,4-oxadiazol-3-yl}phenyl)borsäure [German] [ACD/IUPAC Name]
Acide (4-{5-[(8-méthyl-2,4-dioxo-1,3-diazaspiro[4.5]déc-3-yl)méthyl]-1,2,4-oxadiazol-3-yl}phényl)boronique [French] [ACD/IUPAC Name]
Boronic acid, B-[4-[5-[(8-methyl-2,4-dioxo-1,3-diazaspiro[4.5]dec-3-yl)methyl]-1,2,4-oxadiazol-3-yl]phenyl]- [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:
Vapour Pressure:
Enthalpy of Vaporization:
Flash Point:
Index of Refraction: 1.634
Molar Refractivity: 96.0±0.4 cm3
#H bond acceptors: 9
#H bond donors: 3
#Freely Rotating Bonds: 4
#Rule of 5 Violations: 0
ACD/LogP: 2.86
ACD/LogD (pH 5.5): 2.20
ACD/BCF (pH 5.5): 27.66
ACD/KOC (pH 5.5): 374.21
ACD/LogD (pH 7.4): 2.08
ACD/BCF (pH 7.4): 20.77
ACD/KOC (pH 7.4): 281.07
Polar Surface Area: 129 Å2
Polarizability: 38.1±0.5 10-24cm3
Surface Tension: 74.6±5.0 dyne/cm
Molar Volume: 268.5±5.0 cm3

Click to predict properties on the Chemicalize site


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