ChemSpider 2D Image | 5-Bromo-6-ethyl-2-{5-[(4-methyl-1-piperazinyl)sulfonyl]-2-propoxyphenyl}-4(1H)-pyrimidinone | C20H27BrN4O4S

5-Bromo-6-ethyl-2-{5-[(4-methyl-1-piperazinyl)sulfonyl]-2-propoxyphenyl}-4(1H)-pyrimidinone

  • Molecular FormulaC20H27BrN4O4S
  • Average mass499.422 Da
  • Monoisotopic mass498.093628 Da
  • ChemSpider ID26325866

More details:

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

4(3H)-Pyrimidinone, 5-bromo-6-ethyl-2-[5-[(4-methyl-1-piperazinyl)sulfonyl]-2-propoxyphenyl]- [ACD/Index Name]
5-Brom-6-ethyl-2-{5-[(4-methyl-1-piperazinyl)sulfonyl]-2-propoxyphenyl}-4(1H)-pyrimidinon [German] [ACD/IUPAC Name]
5-Bromo-6-ethyl-2-{5-[(4-methyl-1-piperazinyl)sulfonyl]-2-propoxyphenyl}-4(1H)-pyrimidinone [ACD/IUPAC Name]
5-Bromo-6-éthyl-2-{5-[(4-méthyl-1-pipérazinyl)sulfonyl]-2-propoxyphényl}-4(1H)-pyrimidinone [French] [ACD/IUPAC Name]
5-Bromo-6-Ethyl-2-{5-[(4-Methylpiperazin-1-Yl)sulfonyl]-2-Propoxyphenyl}pyrimidin-4(3h)-One
5BO

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: 1.639
Molar Refractivity: 120.1±0.5 cm3
#H bond acceptors: 8
#H bond donors: 1
#Freely Rotating Bonds: 7
#Rule of 5 Violations: 0
ACD/LogP: 3.32
ACD/LogD (pH 5.5): 1.83
ACD/BCF (pH 5.5): 10.06
ACD/KOC (pH 5.5): 118.02
ACD/LogD (pH 7.4): 1.58
ACD/BCF (pH 7.4): 5.63
ACD/KOC (pH 7.4): 66.07
Polar Surface Area: 100 Å2
Polarizability: 47.6±0.5 10-24cm3
Surface Tension: 52.1±7.0 dyne/cm
Molar Volume: 333.8±7.0 cm3

Click to predict properties on the Chemicalize site


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