ChemSpider 2D Image | JM-1232 | C24H27N3O2

JM-1232

  • Molecular FormulaC24H27N3O2
  • Average mass389.490 Da
  • Monoisotopic mass389.210327 Da
  • ChemSpider ID26231036
  • defined stereocentres - 1 of 1 defined stereocentres


More details:






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

(3R)-3-[2-(4-Methyl-1-piperazinyl)-2-oxoethyl]-2-phenyl-3,5,6,7-tetrahydrocyclopenta[f]isoindol-1(2H)-on [German] [ACD/IUPAC Name]
(3R)-3-[2-(4-Methyl-1-piperazinyl)-2-oxoethyl]-2-phenyl-3,5,6,7-tetrahydrocyclopenta[f]isoindol-1(2H)-one [ACD/IUPAC Name]
(3R)-3-[2-(4-Méthyl-1-pipérazinyl)-2-oxoéthyl]-2-phényl-3,5,6,7-tétrahydrocyclopenta[f]isoindol-1(2H)-one [French] [ACD/IUPAC Name]
Cyclopent[f]isoindol-1(2H)-one, 3,5,6,7-tetrahydro-3-[2-(4-methyl-1-piperazinyl)-2-oxoethyl]-2-phenyl-, (3R)- [ACD/Index Name]
JM-1232 [Wiki]

Predicted data is generated using the ACD/Labs Percepta Platform - PhysChem Module

Density: 1.2±0.1 g/cm3
Boiling Point: 607.9±55.0 °C at 760 mmHg
Vapour Pressure: 0.0±1.7 mmHg at 25°C
Enthalpy of Vaporization: 90.3±3.0 kJ/mol
Flash Point: 274.8±23.9 °C
Index of Refraction: 1.626
Molar Refractivity: 111.6±0.3 cm3
#H bond acceptors: 5
#H bond donors: 0
#Freely Rotating Bonds: 3
#Rule of 5 Violations: 0
ACD/LogP: 3.71
ACD/LogD (pH 5.5): 1.77
ACD/BCF (pH 5.5): 6.39
ACD/KOC (pH 5.5): 56.26
ACD/LogD (pH 7.4): 2.97
ACD/BCF (pH 7.4): 101.43
ACD/KOC (pH 7.4): 893.72
Polar Surface Area: 44 Å2
Polarizability: 44.3±0.5 10-24cm3
Surface Tension: 53.3±3.0 dyne/cm
Molar Volume: 315.2±3.0 cm3

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