ChemSpider 2D Image | 5-(4-{6-[(3,5-Dichloro-4-hydroxyphenyl)amino]-2-(3-methoxyphenyl)-4-pyrimidinyl}-1-piperazinyl)-1,3-benzoxazol-2(3H)-one | C28H24Cl2N6O4

5-(4-{6-[(3,5-Dichloro-4-hydroxyphenyl)amino]-2-(3-methoxyphenyl)-4-pyrimidinyl}-1-piperazinyl)-1,3-benzoxazol-2(3H)-one

  • Molecular FormulaC28H24Cl2N6O4
  • Average mass579.434 Da
  • Monoisotopic mass578.123596 Da
  • ChemSpider ID121589038

More details:

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

2(3H)-Benzoxazolone, 5-[4-[6-[(3,5-dichloro-4-hydroxyphenyl)amino]-2-(3-methoxyphenyl)-4-pyrimidinyl]-1-piperazinyl]- [ACD/Index Name]
5-(4-{6-[(3,5-Dichlor-4-hydroxyphenyl)amino]-2-(3-methoxyphenyl)-4-pyrimidinyl}-1-piperazinyl)-1,3-benzoxazol-2(3H)-on [German] [ACD/IUPAC Name]
5-(4-{6-[(3,5-Dichloro-4-hydroxyphenyl)amino]-2-(3-methoxyphenyl)-4-pyrimidinyl}-1-piperazinyl)-1,3-benzoxazol-2(3H)-one [ACD/IUPAC Name]
5-(4-{6-[(3,5-Dichloro-4-hydroxyphényl)amino]-2-(3-méthoxyphényl)-4-pyrimidinyl}-1-pipérazinyl)-1,3-benzoxazol-2(3H)-one [French] [ACD/IUPAC Name]

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

Density: 1.5±0.1 g/cm3
Boiling Point:
Vapour Pressure:
Enthalpy of Vaporization:
Flash Point:
Index of Refraction: 1.693
Molar Refractivity: 151.0±0.3 cm3
#H bond acceptors: 10
#H bond donors: 3
#Freely Rotating Bonds: 6
#Rule of 5 Violations: 2
ACD/LogP: 4.88
ACD/LogD (pH 5.5): 4.32
ACD/BCF (pH 5.5): 661.24
ACD/KOC (pH 5.5): 1908.22
ACD/LogD (pH 7.4): 4.47
ACD/BCF (pH 7.4): 929.40
ACD/KOC (pH 7.4): 2682.09
Polar Surface Area: 112 Å2
Polarizability: 59.9±0.5 10-24cm3
Surface Tension: 68.6±3.0 dyne/cm
Molar Volume: 393.7±3.0 cm3

Click to predict properties on the Chemicalize site


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