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Search term: NFWXOLWPQYHMBW-UHFFFAOYSA-N (Found by InChIKey (full match))
ChemSpider 2D Image | 2-Butyl-6-methyl-5-{[3-(2-methyl-2-propanyl)-1,2,4-oxadiazol-5-yl]methyl}-3-{[2'-(5-oxo-4,5-dihydro-1,2,4-oxadiazol-3-yl)-4-biphenylyl]methyl}-4(3H)-pyrimidinone | C31H34N6O4

2-Butyl-6-methyl-5-{[3-(2-methyl-2-propanyl)-1,2,4-oxadiazol-5-yl]methyl}-3-{[2'-(5-oxo-4,5-dihydro-1,2,4-oxadiazol-3-yl)-4-biphenylyl]methyl}-4(3H)-pyrimidinone

  • Molecular FormulaC31H34N6O4
  • Average mass554.640 Da
  • Monoisotopic mass554.264160 Da
  • ChemSpider ID78316801

More details:

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

2-Butyl-6-methyl-5-{[3-(2-methyl-2-propanyl)-1,2,4-oxadiazol-5-yl]methyl}-3-{[2'-(5-oxo-4,5-dihydro-1,2,4-oxadiazol-3-yl)-4-biphenylyl]methyl}-4(3H)-pyrimidinon [German] [ACD/IUPAC Name]
2-Butyl-6-methyl-5-{[3-(2-methyl-2-propanyl)-1,2,4-oxadiazol-5-yl]methyl}-3-{[2'-(5-oxo-4,5-dihydro-1,2,4-oxadiazol-3-yl)-4-biphenylyl]methyl}-4(3H)-pyrimidinone [ACD/IUPAC Name]
2-Butyl-6-méthyl-5-{[3-(2-méthyl-2-propanyl)-1,2,4-oxadiazol-5-yl]méthyl}-3-{[2'-(5-oxo-4,5-dihydro-1,2,4-oxadiazol-3-yl)-4-biphénylyl]méthyl}-4(3H)-pyrimidinone [French] [ACD/IUPAC Name]
4(3H)-Pyrimidinone, 2-butyl-3-[[2'-(4,5-dihydro-5-oxo-1,2,4-oxadiazol-3-yl)[1,1'-biphenyl]-4-yl]methyl]-5-[[3-(1,1-dimethylethyl)-1,2,4-oxadiazol-5-yl]methyl]-6-methyl- [ACD/Index Name]
2366255-59-4 [RN]
2-butyl-5-[(3-tert-butyl-1,2,4-oxadiazol-5-yl)methyl]-6-methyl-3-{[2'-(5-oxo-4,5-dihydro-1,2,4-oxadiazol-3-yl)[1,1'-biphenyl]-4-yl]methyl}pyrimidin-4(3H)-one
3-[2-[4-[[2-butyl-5-[(3-tert-butyl-1,2,4-oxadiazol-5-yl)methyl]-4-methyl-6-oxopyrimidin-1-yl]methyl]phenyl]phenyl]-4H-1,2,4-oxadiazol-5-one
BR102375

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: 1.644
Molar Refractivity: 156.0±0.5 cm3
#H bond acceptors: 10
#H bond donors: 1
#Freely Rotating Bonds: 10
#Rule of 5 Violations: 2
ACD/LogP: 4.88
ACD/LogD (pH 5.5): 4.47
ACD/BCF (pH 5.5): 1452.69
ACD/KOC (pH 5.5): 6324.93
ACD/LogD (pH 7.4): 3.93
ACD/BCF (pH 7.4): 421.14
ACD/KOC (pH 7.4): 1833.63
Polar Surface Area: 122 Å2
Polarizability: 61.8±0.5 10-24cm3
Surface Tension: 48.4±7.0 dyne/cm
Molar Volume: 431.1±7.0 cm3

Click to predict properties on the Chemicalize site


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