ChemSpider 2D Image | 2-{5-[(4-Methyl-1-piperazinyl)sulfonyl]-2-propoxyphenyl}-1,5,6,7-tetrahydro-4H-cyclopenta[d]pyrimidin-4-one | C21H28N4O4S

2-{5-[(4-Methyl-1-piperazinyl)sulfonyl]-2-propoxyphenyl}-1,5,6,7-tetrahydro-4H-cyclopenta[d]pyrimidin-4-one

  • Molecular FormulaC21H28N4O4S
  • Average mass432.536 Da
  • Monoisotopic mass432.183136 Da
  • ChemSpider ID28665344

More details:

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

2-{5-[(4-Methyl-1-piperazinyl)sulfonyl]-2-propoxyphenyl}-1,5,6,7-tetrahydro-4H-cyclopenta[d]pyrimidin-4-on [German] [ACD/IUPAC Name]
2-{5-[(4-Methyl-1-piperazinyl)sulfonyl]-2-propoxyphenyl}-1,5,6,7-tetrahydro-4H-cyclopenta[d]pyrimidin-4-one [ACD/IUPAC Name]
2-{5-[(4-Méthyl-1-pipérazinyl)sulfonyl]-2-propoxyphényl}-1,5,6,7-tétrahydro-4H-cyclopenta[d]pyrimidin-4-one [French] [ACD/IUPAC Name]
2-{5-[(4-Methylpiperazin-1-Yl)sulfonyl]-2-Propoxyphenyl}-3,5,6,7-Tetrahydro-4h-Cyclopenta[d]pyrimidin-4-One
4H-Cyclopenta[d]pyrimidin-4-one, 3,5,6,7-tetrahydro-2-[5-[(4-methyl-1-piperazinyl)sulfonyl]-2-propoxyphenyl]- [ACD/Index Name]
NI5

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: 1.663
Molar Refractivity: 114.8±0.5 cm3
#H bond acceptors: 8
#H bond donors: 1
#Freely Rotating Bonds: 6
#Rule of 5 Violations: 0
ACD/LogP: 2.90
ACD/LogD (pH 5.5): 1.36
ACD/BCF (pH 5.5): 4.42
ACD/KOC (pH 5.5): 66.01
ACD/LogD (pH 7.4): 1.99
ACD/BCF (pH 7.4): 18.85
ACD/KOC (pH 7.4): 281.25
Polar Surface Area: 100 Å2
Polarizability: 45.5±0.5 10-24cm3
Surface Tension: 55.3±7.0 dyne/cm
Molar Volume: 309.7±7.0 cm3

Click to predict properties on the Chemicalize site


Advertisement