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Search term: GAUBBXXRRPWLHO (Found by InChIKey (skeleton match))
ChemSpider 2D Image | N,N'-[1,4-Phenylenebis(methylene)]bis(N-ethyl-5-methyl-3-phenyl-1,2-oxazole-4-carboxamide) | C34H34N4O4

N,N'-[1,4-Phenylenebis(methylene)]bis(N-ethyl-5-methyl-3-phenyl-1,2-oxazole-4-carboxamide)

  • Molecular FormulaC34H34N4O4
  • Average mass562.658 Da
  • Monoisotopic mass562.257996 Da
  • ChemSpider ID289481

More details:

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

4-Isoxazolecarboxamide, N,N'-[1,4-phenylenebis(methylene)]bis[N-ethyl-5-methyl-3-phenyl- [ACD/Index Name]
N,N'-(1,4-Phenylendimethylen)bis(N-ethyl-5-methyl-3-phenyl-1,2-oxazol-4-carboxamid) [German] [ACD/IUPAC Name]
N,N'-(1,4-Phénylènediméthylène)bis(N-éthyl-5-méthyl-3-phényl-1,2-oxazole-4-carboxamide) [French] [ACD/IUPAC Name]
N,N'-[1,4-Phenylenebis(methylene)]bis(N-ethyl-5-methyl-3-phenyl-1,2-oxazole-4-carboxamide) [ACD/IUPAC Name]
N4-ethyl-N4-[4-({ethyl[(5-methyl-3-phenylisoxazol-4-yl)carbonyl]amino}methyl)benzyl]-5-methyl-3-phenylisoxazole-4-carboxamide

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

NSC299384 [DBID]

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

Density: 1.2±0.1 g/cm3
Boiling Point: 822.5±65.0 °C at 760 mmHg
Vapour Pressure: 0.0±3.0 mmHg at 25°C
Enthalpy of Vaporization: 119.5±3.0 kJ/mol
Flash Point: 451.2±34.3 °C
Index of Refraction: 1.601
Molar Refractivity: 160.9±0.3 cm3
#H bond acceptors: 8
#H bond donors: 0
#Freely Rotating Bonds: 10
#Rule of 5 Violations: 1
ACD/LogP: 2.52
ACD/LogD (pH 5.5): 4.29
ACD/BCF (pH 5.5): 1070.01
ACD/KOC (pH 5.5): 5129.05
ACD/LogD (pH 7.4): 4.29
ACD/BCF (pH 7.4): 1070.01
ACD/KOC (pH 7.4): 5129.05
Polar Surface Area: 93 Å2
Polarizability: 63.8±0.5 10-24cm3
Surface Tension: 50.3±3.0 dyne/cm
Molar Volume: 469.6±3.0 cm3

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